CandActCFTR
CandActCFTR Seed Compounds
The following 3114 structures with currently 268914 synonyms are a list compounds which have been reported in 111 CFTR related publications published in the past decade. We collected all structures regardless of an activation of CFTR function or an improvement of CFTR processing, thus also including reported negative compound references or even inhibitors.
ID: 3001
InChIKey: QRQWTUGZDQPGSF-UHFFFAOYSA-N
SMILES: C1C2C(CC3C=CC(OC)=CC=3)C(C3=CC=CC=C3)=CC(=S)C=2C=CC=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3002
InChIKey: QTRHBAKCRRQFSF-UHFFFAOYSA-N
SMILES: C([HH0])1C(CCC=C)=NN([HH0])C1=O
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3003
InChIKey: QVDYQHXNAQHIKH-TZIWHRDSSA-N
SMILES: c1cc(ccc1[C@H]2C[C@H](c3ccc(cc3O2)OC(F)F)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F)C(=O)O
biological descriptors:
CFTR relevance: CFTR corrector, highly potent and efficacious
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301049
synonyms found at PubChem are:
J0IIT8QSQS, UNII-J0IIT8QSQS, ABBV-2222, Galicaftor, Galicaftor [INN], GLPG2222, SCHEMBL17708714, GLPG-2222, QVDYQHXNAQHIKH-TZIWHRDSSA-N, 1918143-53-9, 4-[(2R,4R)-4-({[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl]carbonyl}amino)-7-(difluoromethoxy)-3,4-dihydro-2H-chromen-2-yl]benzoic acid, Benzoic acid, 4-((2R,4R)-4-(((1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl)carbonyl)amino)-7-(difluoromethoxy)-3,4-dihydro-2H-1-benzopyran-2-yl)-
ID: 3004
InChIKey: RDCTWYMYQJASTI-UHFFFAOYSA-N
SMILES: C1=CC=CC(C(=O)CC(=O)C2=NC=CC=C2)=C1OCC1=CC=C(OC)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3005
InChIKey: RDSLFJCBOOTJSQ-CPNJWEJPSA-N
SMILES: C(/C(=N/NC1=CC=CC=C1)/C)1C(C)=NN(C2=CC=CC=C2)C1=O
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
CID is 14784238
ID: 3006
InChIKey: RFPAGSRGRRCKGS-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OC=C)=C(C)NC(C)=C1C(=O)OCC
biological descriptors:
CFTR relevance: CFTR activator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"P Fossa"
"F Cateni"
"M Giampieri"
"M Mazzei"
"MT Mazzei"
"LJ Galietta"
"M Zacchigna"
"N Pedemonte"
ID: 3007
InChIKey: RFPDEKVGEQJZQX-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC(F)=CC=3)=CC(=O)C=2C2C=CC=CC=2C=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
CID is 86134087
ID: 3008
InChIKey: RRMCKZQFEOZJLN-UHFFFAOYSA-M
SMILES: [ClH0-].N12C=CC=C(C)C1=NC1=[NH0+](C=CC=C1C)C2
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3009
InChIKey: RSOZZQTUMVBTMR-XGUNBQNXSA-N
SMILES: CC(=O)O[C@H]1[C@H]([C@@H]2[C@]([C@H](CCC2(C)C)O)([C@@]3([C@@]1(O[C@@](CC3=O)(C)C=C)C)O)C)OC(=O)CCN(C)C
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"B Kus"
"JW Hanrahan"
"J Liao"
"R Robert"
"E Matthes"
"J Goepp"
"DY Thomas"
"SD Macknight"
"GW Carlile"
"D Rotin"
CID is 444029
synonyms found at PubChem are:
Colforsin daropate, UNII-1196KQZ976, 1196KQZ976, 113462-26-3, Colforsin dapropate HCl, colforsin dapropate, colforsin daropate HCl, AC1L9FKS, 138605-00-2, SCHEMBL219972, CHEBI:31429, DTXSID20150415, ZINC3803653, NCGC00025227-02, NCGC00025227-03, beta-Alanine, N,N-dimethyl-, (3R,4aR,5S,6S,6aS,10S,10aR,10bS)-5-(acetyloxy)-3-ethenyldodecahydro-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-1H-naphtho(2,1-b)pyran-6-yl ester, [(3R,4aR,5S,6S,6aS,10S,10aR,10bS)-5-acetyloxy-3-ethenyl-10,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-6-yl] 3-(dimethylamino)propanoate
ID: 3010
InChIKey: RTBMADYWNFZUHP-UHFFFAOYSA-N
SMILES: C1=CC=C(OC)C(OC)=C1C1CC(C2=C(O)C=CC=C2OC)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3011
InChIKey: RTKIYFITIVXBLE-QEQCGCAPSA-N
SMILES: C[C@H](/C=C(\C)/C=C/C(=O)NO)C(=O)C1=CC=C(C=C1)N(C)C
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"M Gentzsch"
"W Kellner"
"JM Pilewski"
"D Herman"
"RA Frizzell"
"JM Gottesfeld"
"WE Balch"
"JW Kelly"
"DM Hutt"
"S Noel"
"B Hoch"
"PJ Thomas"
"T Okiyoneda"
"JR Riordan"
"A Schmidt"
"Y Matsumura"
"G Manning"
"WR Skach"
"GL Lukacs"
"J Matteson"
"AP Rodrigues"
"EJ Sorscher"
"JR_3rd Yates"
CID is 444732
synonyms found at PubChem are:
trichostatin A, 58880-19-6, Trichostatin A (TSA), TSA, Trichostatin, UNII-3X2S926L3Z, CHEBI:46024, (2E,4E,6R)-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, GNF-PF-1011, RTKIYFITIVXBLE-QEQCGCAPSA-N, 3X2S926L3Z, 2,4-Heptadienamide, 7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-, 7-(4-(Dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, [R-(E,E)]-7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, Q-201864, Tricostatin A, (2E,4E,6R)-7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-2,4-heptadienamide, 7-[4-(DIMETHYLAMINO)PHENYL]-N-HYDROXY-4,6-DIMETHYL-7-OXO-2,4-HEPTADIENAMIDE, 2,4-Heptadienamide, 7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)-, TSN, trichostatine a, Trichlostatin A, (2E,4E,6R)-7-(4-dimethylaminophenyl)-4,6-dimethyl-7-oxo-hepta-2,4-dienehydroxamic acid, (2E,4E,6R)-7-(4-Dimethylaminophenyl)-N-hydroxy-4,6-dimethyl-7-oxo-hepta-2,4-dienamide, Trichostatin A,TSA, Trichostatin A/TSA, Antibiotic A-300, (R)-Trichostatin A, NCGC_TSA, 1c3r, 3f0r, Trichostatin-A - TSA, AC1L9GSU, A 300, D0NF6F, SCHEMBL19886, MLS006011095, SGCTO-002, SCHEMBL675951, GTPL7005, DTXSID6037063, CHEBI:93196, MolPort-003-959-819, MolPort-044-724-267, ZX-AFC000233, BCPP000035, HMS1362L09, HMS1792L09, HMS1990L09, HMS3403L09, HMS3649O20, BCP01776, EX-A1665, ABP000141, BDBM50005711, LMPK01000055, MFCD03848392, s1045, Trichostatin A from Streptomyces sp., AKOS015899840, ZINC100014731, A-300-I, CCG-208142, CCG-208681, CS-0499, DB04297, RL04219, NCGC00162453-01, NCGC00162453-02, NCGC00162453-03, NCGC00162453-04, NCGC00162453-05, NCGC00162453-15, 3C10, HY-15144, KB-81257, LS-74195, M984, SC-73346, SMR004702883, A8183, M02571, W-5309, 880T196, SR-05000013796, SR-05000013796-3, BRD-K68202742-001-04-1, BRD-K68202742-001-05-8, I14-11732, Trichostatin A, >=98% (HPLC), from Streptomyces sp., UNII-30RHG284Z4 component RTKIYFITIVXBLE-QEQCGCAPSA-N, Trichostatin A??, Vetec(TM) reagent grade, from Streptomyces sp., >=98%, (2E,4E,6R)-7-(4-dimethylaminophenyl)-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, (6R)-N-Hydroxy-4,6-dimethyl-7-oxo-7-[4-(dimethylamino)phenyl]-2,4-heptadienamide, (R,2E,4E)-7-(4-(dimethylamino)phenyl)-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide, 7-[4-(Dimethylamino)phenyl]-N-hydroxy-4,6R-dimethyl-7-oxo-2E,4E-heptadienamide, 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, (2E,4E,6R)- (9CI), 2,4-Heptadienamide, 7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxo-, [R-(E,E)]-
ID: 3012
InChIKey: RWSCLIMEWLULIU-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC(C4=CC=C(SC)C=C4)=CC=3)=CC(=O)C=2C(O)=CC=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3013
InChIKey: SEUJVWBTKUOHEQ-UHFFFAOYSA-N
SMILES: C1(=CC=CC=C1)COCC1ON=C(C2=NOC(COCC3=CC=CC=C3)=C2)C=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3014
InChIKey: SFCMPVWUVZLOFH-UHFFFAOYSA-N
SMILES: COC(=O)C1=C2C(=NC(=N1)N)CNC(=O)C3=C2C(=C(N3)Br)Br
biological descriptors:
CFTR relevance: CFTR Trafficking Corrector, PARP inhibitor
Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment ER & Golgi (Translation, quality control, trafficking, PTM)
reference list:
"RM Centko"
"KA Teske"
"RG Linington"
"J Liao"
"R Robert"
"D Zhang"
"RJ Andersen"
"JW Hanrahan"
"SM Anjos"
"L Yan"
"RA Keyzers"
"DY Thomas"
"GW Carlile"
"CA Gray"
"DE Williams"
"HM Sampson"
CID is 25168132
synonyms found at PubChem are:
SCHEMBL13042346, 1,2-Dibromo-4-oxo-8-amino-3,4,5,6-tetrahydro-3,5,7,9-tetraazabenzo[e]azulene-10-carboxylic acid methyl ester
ID: 3015
InChIKey: SJCSTIDLOLDATR-UHFFFAOYSA-M
SMILES: [IH0-].S1C2C=CC=CC=2N2C([HH0])=[NH0+]3C4C=CC=CC=4SC3=NC12
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3016
InChIKey: SJHUDINIMLGKDO-UHFFFAOYSA-N
SMILES: C1=CC=CC2C=CC(C(=O)C)=C(OC(=O)C3=CC(C(F)(F)F)=CC=C3)C1=2
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3017
InChIKey: SLHLHESUSCADMP-UHFFFAOYSA-N
SMILES: C1C(C)CC(Br)C2NC3C(=O)CCCC=3C1=2
biological descriptors:
CFTR relevance: strong CFTR potentiator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment
reference list:
"T Ma"
"AS Verkman"
"H Yang"
"AA Shelat"
"C Folli"
"LJ Galietta"
"K Du"
"RK Guy"
"N Pedemonte"
"GL Lukacs"
"VS Gopinath"
"A Taddei"
CID is 85871990
ID: 3018
InChIKey: SPJAGELQBZMCPJ-UHFFFAOYSA-N
SMILES: C1=CC(OC)=C(OC)C=C1C1CC(C2=C(O)C=CC=C2O)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3019
InChIKey: SRKHILYHEMRDJV-NFBKMPQASA-N
SMILES: COc1ccc2c(c1)[C@@H](C[C@@H](O2)c3cccc(c3)C(=O)O)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301024
synonyms found at PubChem are:
SCHEMBL17708687
ID: 3020
InChIKey: SUNJYLTZHCRJAG-UHFFFAOYSA-N
SMILES: [IH0-].C12C(O)=CC=CN1C[NH0+]1C=CC=C(O)C=1N=2
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3021
InChIKey: SWNGJEHCLHVUNW-UHFFFAOYSA-M
SMILES: [NH0+](CC1CCC(CO)CC1)1C=C2C=CC=CC2=CC=1.CCCCCCCCCCCCOS(=O)(=O)[OH0-]
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3022
InChIKey: SXWPGTCAGAAPEV-UHFFFAOYSA-N
SMILES: O(CCC1ON=C(C2OC=CC=2)C=1)CC1=CC(C2C=C(COCCCC)ON=2)=NO1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3023
InChIKey: SZMWXXPEXYKTGC-UHFFFAOYSA-N
SMILES: C1(OC=CC=1)C1C=C(COCC2=CC(C3C=C(COCCCC)ON=3)=NO2)ON=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3024
InChIKey: UBRGWUAONWVDKB-UHFFFAOYSA-N
SMILES: [ClH0-].C1(=CC=CC=C1)CC1C[NH0+]2C=CC=CC=2C(=O)N1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3025
InChIKey: UNOWBPZMWCFSSM-UHFFFAOYSA-N
SMILES: C1=CC(OC)=C(OC)C=C1C1CC(C2=C(O)C=CC=C2OC)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3026
InChIKey: UPIBBGPXNOPIDA-UHFFFAOYSA-N
SMILES: C(C1=C(SCC(=C)OC)C=CS1)1C(C(=O)OC2C=CC=CC=2)=C(C)NC(C)=C1C(=O)OCC
biological descriptors:
CFTR relevance: CFTR activator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"P Fossa"
"F Cateni"
"M Giampieri"
"M Mazzei"
"MT Mazzei"
"LJ Galietta"
"M Zacchigna"
"N Pedemonte"
ID: 3027
InChIKey: UQCWVRJXPVVQMB-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC=C(F)C=3)=C(C)C(=O)C=2C=CC=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3028
InChIKey: UTVVEKUCCRQJLL-TZIWHRDSSA-N
SMILES: c1cc(cc(c1)C(=O)O)[C@H]2C[C@H](c3ccc(cc3O2)F)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301297
synonyms found at PubChem are:
SCHEMBL17708985
ID: 3029
InChIKey: UYJZZVDLGDDTCL-UHFFFAOYSA-N
SMILES: CN(C)CC(=O)NC1=CC2=C(C=C1)NC(=O)C3=CC=CC=C32
biological descriptors:
CFTR relevance: PARP inhibitor
Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment Nucleus (Transcription)
reference list:
"RM Centko"
"KA Teske"
"RG Linington"
"J Liao"
"R Robert"
"D Zhang"
"RJ Andersen"
"JW Hanrahan"
"SM Anjos"
"L Yan"
"RA Keyzers"
"DY Thomas"
"GW Carlile"
"CA Gray"
"DE Williams"
"HM Sampson"
"R Phillipe"
"F Dantzer"
"J Liao"
"R Robert"
"H Balghi"
"P Ferraro"
"F Ciciriello"
"JW Hanrahan"
"D Waller"
"SM Anjos"
"J Goepp"
"DY Thomas"
"P Lesimple"
"GW Carlile"
"DL Zhang"
"HM Sampson"
CID is 4858
synonyms found at PubChem are:
PJ34, 344458-19-1, pj-34, CHEMBL372303, UYJZZVDLGDDTCL-UHFFFAOYSA-N, N~2~,N~2~-DIMETHYL-N~1~-(6-OXO-5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE, P34, 2-(dimethylamino)-N-(6-oxo-5,6-dihydrophenanthridin-2-yl)acetamide, Acetamide, N-(5,6-dihydro-6-oxo-2-phenanthridinyl)-2-(dimethylamino)-, PJ34(free base), 1xk9, D04WDX, SCHEMBL422317, AC1L1J45, ZINC8960, BDBM27497, CTK1B7701, Ibrutinib (PCI32765 pound(c), MolPort-035-395-737, HMS3651B06, BCP07990, 2662AH, HY-13688A, AKOS030229047, CS-1463, DB08348, NCGC00370866-10, AJ-08322, BC600341, DA-42692, AB0109995, FT-0722456, W-5671, BRD-K11853856-003-01-3, 2-(dimethylamino)-N-(6-oxo-5H-phenanthridin-2-yl)acetamide, 2-(dimethylamino)-N-(5,6-dihydro-6-oxophenanthridin-2yl)acetamide, 2-Dimethylamino-N-(6-oxo-5,6-dihydro-phenanthridin-2-yl)-acetamide, N-(6-oxo-5,6-dihydro- phenanthridin-2-yl)-N,N-dimethylacetamide, N-(5,6-Dihydro-6-oxo-2-phenanthridinyl)-2-(dimethylamino)-acetamide
ID: 3030
InChIKey: UYVWZMMXIHKTSX-KPKJPENVSA-N
SMILES: C(/C=N/O)1C(C2=CC=CC=C2)=NN(C)C1=O
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3031
InChIKey: VFYMPIDZJNUFJK-UHFFFAOYSA-N
SMILES: C1CNC(=O)C2[NH0]C(Br)=C(C)C=2C=1
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3032
InChIKey: VJJQODKBSDDABN-ULAWRXDQSA-N
SMILES: N(CC(F)(F)C)1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)C1
biological descriptors:
CFTR relevance: Non-effective CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"V Cendret"
"T Legigan"
"M Forcella"
"P Parenti"
"I Adachi"
"C Norez"
"S Thibaudeau"
"J Désiré"
"F Becq"
"Y Blériot"
"A Mingot"
"A Kato"
"J Bertrand"
ID: 3033
InChIKey: VKMQILQFLGSWPG-UHFFFAOYSA-N
SMILES: C1(=C(OCC2=CC=C(OC)C=C2)C=CC=C1)C(=O)CC(O)C1=CC=CC=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3034
InChIKey: VNEPQZCFCFKOKO-UHFFFAOYSA-N
SMILES: C1=CC=CC2C(=O)C=C(C3C=CC=CC=3)C(CC3=CC=CC=C3)C1=2
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3035
InChIKey: VQWYENSHOSDORF-UTINFBMNSA-N
SMILES: N(CCC#C)1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)C1
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"V Cendret"
"T Legigan"
"M Forcella"
"P Parenti"
"I Adachi"
"C Norez"
"S Thibaudeau"
"J Désiré"
"F Becq"
"Y Blériot"
"A Mingot"
"A Kato"
"J Bertrand"
ID: 3036
InChIKey: VRKZEOFXEIZHKY-UHFFFAOYSA-N
SMILES: C(O)1CNC(=O)C2[NH0]C(Br)=C(C)C=2C=1
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3037
InChIKey: VVVFEOSCKXCYBU-UHFFFAOYSA-N
SMILES: CN1C2=C(C=C(C=C2)Br)N=C1CO
biological descriptors:
CFTR relevance: ß-site binder
Category:
Influence on CFTR function unknown
Order of interaction binds to CFTR
subcellular compartment several
reference list:
"PA Chong"
"AE Aulabaugh"
"LJ Byrnes"
"IV Efremov"
"S Shanker"
"JD Hall"
"H Wang"
"K Wang"
"JD Forman-Kay"
CID is 63758472
synonyms found at PubChem are:
MolPort-020-519-908, AKOS013069650, (5-bromo-1-methyl-1H-1,3-benzodiazol-2-yl)methanol
ID: 3038
InChIKey: WCALFYGEAUOGIB-UHFFFAOYSA-N
SMILES: C([NH0+](=O)[OH0-])1=CC=C(C(=O)OC2=CC(OC(=C)C3=CC=C([NH0+](=O)[OH0-])C=C3)=C(C(=O)C)C=C2)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3039
InChIKey: WCGWXWMIXLFLMB-UHFFFAOYSA-N
SMILES: C1(=C(OCC2=CC=C(OC)C=C2)C=CC=C1)C(=O)CC(=O)C1=CC=CC=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3040
InChIKey: WDJUZGPOPHTGOT-XUDUSOBPSA-N
SMILES: C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2O)O[C@@H]3[C@H](O[C@H](C[C@@H]3O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(CC[C@@H]7C8=CC(=O)OC8)O)C)C)C)C)O)O
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"JW Hanrahan"
"SM Anjos"
"A Luini"
"J Liao"
"R Robert"
"H Balghi"
"A Carissimo"
"D Zhang"
"DY Thomas"
"GW Carlile"
"F Ciciriello"
CID is 441207
synonyms found at PubChem are:
digitoxin, Digitoxoside, 71-63-6, Unidigin, Digitoxinum, Coramedan, Crystodigin (TN), Digipural, Asthenthilo, Digitossina, Digitoxosidum, Carditalin, Digitoksim, Digitoxina, Digitoxine, Monodigitoxoside, Mono-digitoxid, Mono-glycocard, Cardidigin, Carditoxin, Crystodigin, Digitoksin, Cardigin, Digitophyllin, Digitossina [DCIT], Acedoxin, Cristapurat, Digimerck, Digisidin, Myodigin, Purpurid, Tardigal, Digicor, Digitalin, crystalline, Digitaline, Mono-digitoxid [German], Digitoxine [INN-French], Digitoxinum [INN-Latin], Tri-digitoxoside [German], Digitoxina [INN-Spanish], Digitoxigenin-tridigitoxosid, UNII-E90NZP2L9U, Digitaline nativelle, Digilong, Digimed, Digitrin, Ditaven, Glucodigin, Lanatoxin, Natigal, Purodigin, Tri-digitoxoside, Digitalinum verum, De-Tone, Crystalline digitalin, Digitoxigenin tridigitoxoside, Digitoxigenin-tridigitoxosid [German], Digitaline cristallisee, Purodigin, crystalline, E90NZP2L9U, MLS000069787, CHEBI:28544, Caswell No. 349, SMR000058529, DSSTox_CID_2933, Digitoxin [INN:BAN:JAN], DSSTox_RID_76793, Crystalline, DSSTox_GSID_22933, CCRIS 7116, HSDB 215, Cardiolanata, Lanostabil, Digilanid, Pandigal, Panlanat, NSC 7529, EINECS 200-760-5, C41H64O13, EPA Pesticide Chemical Code 097002, BRN 0076678, CAS-71-63-6, 1339-93-1, 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide, inhibits Na+/K+ ATPase, NSC7529, tradigal, Digitoxin [USP:INN:BAN:JAN], Digitaline (TN), NCGC00159428-02, 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-4-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, Card-20(22)-enolide, 3-((O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)-, AC1L9AQX, D0M3QP, SCHEMBL20940, Digitoxin (JP15/USP/INN), Digitoxin (JP17/USP/INN), CHEMBL254219, cid_441207, GTPL6782, MEGxp0_001901, DTXSID0022933, REGID_for_CID_441207, ACon0_000319, ACon1_000610, BDBM46356, 5.beta.-Card-20(22)-enolide, 3.beta.,14-dihydroxy-, 3-[tris-(digitoxoside)], MolPort-001-742-606, WDJUZGPOPHTGOT-XUDUSOBPSA-N, Card-20(22)-enolide, 3-((O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxy, (3beta,5beta)-, HY-B1357, Tox21_111659, Tox21_302269, LMST01120018, MFCD00003686, ZINC95862733, AKOS015915863, Digitoxin, >=92% (HPLC), powder, Tox21_111659_1, CCG-208538, CS-5502, DB01396, MCULE-8291336831, MCULE-9783596421, SMP1_000096, NCGC00142623-02, NCGC00142623-03, NCGC00142623-04, NCGC00142623-05, NCGC00255265-01, SC-43721, ST072187, SBI-0051348.P003, D0542, LT00244784, Y0070, 6467-EP1441224A2, 6467-EP2270011A1, C06955, D00297, 16732-EP2280955A2, 16732-EP2280980A1, 16732-EP2292612A2, 16732-EP2300441A1, 16732-EP2301938A1, 16732-EP2303866A2, 16732-EP2307386A1, 16732-EP2315764A2, 16732-EP2376427A1, 16732-EP2376433A1, 071D636, Q-100791, SR-01000721879-2, BRD-K63668566-001-01-7, I14-53595, A572A148-EC30-47D2-A32A-C9D8A93F8EFC, Z1558290128, Digitoxin, European Pharmacopoeia (EP) Reference Standard, Digitoxin, United States Pharmacopeia (USP) Reference Standard, UNII-3899510F8M component WDJUZGPOPHTGOT-XUDUSOBPSA-N, (3beta,5beta)-3-{[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy}-14-hydroxycard-20(22)-enolide, 1367-39-1, 1391-34-0, 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13, 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, 3beta-[2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide, 4-((1S,2S,5S,11S,7R,10R,14R,15R)-5-{5-[5-((2S,4S,5S,6R)-4,5-dihydroxy-6-methyl (2H-3,4,5,6-tetrahydropyran-2-yloxy))(4S,5S,2R,6R)-4-hydroxy-6-methyl(2H-3,4,5 ,6-tetrahydropyran-2-yloxy)](4S,5S,2R,6R)-, 4-((1S,2S,5S,11S,7R,10R,14R,15R)-5-{5-[5-((2S,4S,5S,6R)-4,5-dihydroxy-6-methyl (2H-3,4,5,6-tetrahydropyran-2-yloxy))(4S,5S,2R,6R)-4-hydroxy-6-methyl(2H-3,4,5 ,6-tetrahydropyran-2-yloxy)](4S,5S,2R,6R)-4-hydroxy-6-methyl(2H-3,4,5,6-tetrah ydropyran-2-yloxy), 4-((3S,5R,8R,9S,10S,13R,14S,17R)-3-(((2R,4S,5S,6R)-5-(((2S,4S,5S,6R)-5-(((2S,4S,5S,6R)-4,5-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-14-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)furan-2(5H)-one, 4-[(1S,2S,5S,7R,10R,11S,14R,15R)-5-{[(2R,4S,5S,6R)-5-{[(2S,4S,5S,6R)-5-{[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]-2,5-dihydrofuran-2-one, 4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-5H-furan-2-one, 4-hydroxy-6-methyl(2H-3,4,5,6-tetrah ydropyran-2-yloxy)}-11-hydroxy-2,15-dimethyltetracyclo[8.7.0.0<2,7>.0<11,15>]h eptadec-14-yl)-5-hydrofuran-2-one, 5beta,20(22)-Cardenolide-3beta,14-diol-3-(O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-[1-->4]-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-[1-->4]-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy, 82476-56-0, Card-20(22)-enolide, 3-((O-2,6-dideoxy-.beta.-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-.beta.-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-.beta.-D-ribo-hexopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)-, Card-20(22)-enolide, 3-((O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1->4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)-, Card-20(22)-enolide, 3-((O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1.fwdarw.4)-O-2,6-dideoxy-beta-D-ribo-hexopyranosyl-(1.fwdarw.4)-2,6-dideoxy-beta-D-ribo-hexopyranosyl)oxy)-14-hydroxy-, (3beta,5beta)-
ID: 3041
InChIKey: WDOJXVAIIUMGJQ-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC(C(C)(C)C)=CC=3)=CC(=O)C=2C=CC=1OC
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3042
InChIKey: WDPIZEKLJKBSOZ-UHFFFAOYSA-N
SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=C4C=CC(=CC4=CC(=C3O)S(=O)(=O)[O-])S(=O)(=O)O.[Na+]
biological descriptors:
CFTR relevance: CFTR corrector, pocket 2
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment several
reference list:
"J Fritsch"
"M Dadlez"
"P Zielenkiewicz"
"G Wieczorek"
"L Wiszniewski"
"G Faure"
"K Tarnowski"
"S Bitam"
"C Norez"
"M Ollero"
"J Colas"
"N Odolczyk"
"EL Saussereau"
"N Servel"
"A Roldan"
"D Tondelier"
"F Becq"
"A Edelman"
"P Melin-Heschel"
"A Kupniewska"
"MF da Cunha"
"H Herrmann"
"GL Lukacs"
CID is 5351640
synonyms found at PubChem are:
NSC11237, NSC-11237, Ammonium,6-disulfo-1-naphthyl)benzylidene]-2,5-cyclohexadien-1-ylidene]dimethyl-, hydroxide, inner salt, sodium salt, Methanaminium,6-disulfo-1-naphthalenyl)methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, hydroxide, inner salt, monosodium salt
ID: 3043
InChIKey: WEDFRZABLLNRKY-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC(C4OC=C5C=CC=CC=45)=CC=3)=CC(=O)C=2C(O)=CC=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3044
InChIKey: WEPANVRUSUCVPC-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C2CC(c3ccccc3O2)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301188
synonyms found at PubChem are:
SCHEMBL17708869
ID: 3045
InChIKey: WFAARERSPOAPHJ-JJNLEZRASA-N
SMILES: C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)SC=C(N)O)O)O
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"B Kus"
"JW Hanrahan"
"J Liao"
"R Robert"
"E Matthes"
"J Goepp"
"DY Thomas"
"SD Macknight"
"GW Carlile"
"D Rotin"
CID is 445807
ID: 3046
InChIKey: WFFCYRNGFPIJHW-UHFFFAOYSA-N
SMILES: C1(=CC=CC=C1C(OCC2=CC=C(C(=C2)OC(CC3=C(C=CC=C3)C(F)(F)F)=O)C(C)=O)=O)C(F)(F)F
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3047
InChIKey: WGMFVIIZSHBZJC-UHFFFAOYSA-N
SMILES: C1C2OC(C3C=CC(C4=CSC=C4)=CC=3)=CC(=O)C=2C(O)=CC=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3048
InChIKey: WMNXVNCBIDSIQZ-UHFFFAOYSA-N
SMILES: C1CNC(=O)C2[NH0]C(C)=C(C)C=2C=1
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3049
InChIKey: WQEAXCMYYLABKB-UHFFFAOYSA-N
SMILES: C2(=CC1=C([N]C(=C1Br)C)C(=O)NC2)OC
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3050
InChIKey: WTFGHMZUJMRWBK-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1Br)C(=CN2)CC(=O)O
biological descriptors:
CFTR relevance: BIA site binder
Category:
Influence on CFTR function none
Order of interaction binds to CFTR
subcellular compartment several
reference list:
"PA Chong"
"AE Aulabaugh"
"LJ Byrnes"
"IV Efremov"
"S Shanker"
"JD Hall"
"H Wang"
"K Wang"
"JD Forman-Kay"
CID is 96734
synonyms found at PubChem are:
40432-84-6, 5-Bromoindole-3-acetic acid, 2-(5-bromo-1H-indol-3-yl)acetic acid, (5-Bromo-1H-indol-3-yl)-acetic acid, 1h-indole-3-acetic acid, 5-bromo-, (5-bromo-1H-indol-3-yl)acetic acid, 5-Bromo-3-indoleacetic acid, CHEMBL82440, 5-BROMO-1H-INDOLE-3-ACETIC ACID, 5-Bromoindole-3-aceticacid, 4ojq, NSC88145, EINECS 254-917-8, PubChem15852, ACMC-1AO2Y, 5-BR-IAA, 5-Bromoindole-3acetic acid, AC1L3X3R, AC1Q1H9S, 5-bromo-3-indolylacetic acid, KSC237Q3N, SCHEMBL1519655, CTK1D7836, DTXSID90193455, MolPort-001-759-338, WTFGHMZUJMRWBK-UHFFFAOYSA-N, ZINC404314, AC1Q7506, AC1Q7507, ACT04939, BCP27605, 1H-Indole-3-aceticacid, 5-bromo-, 5-Bromoindole-3-acetic acid, 97%, ANW-50901, BDBM50201889, MFCD00005637, NSC-88145, SBB066626, AKOS005259035, AC-9216, AN-7234, CB-1372, CS-W008295, MCULE-7197362248, QC-9166, RP29054, RTR-016148, TRA0042858, VI30266, AJ-22322, BC004052, BR-30397, DS-12031, KB-42477, 2-(5-bromo-1H-indol-3-yl)-acetic acid, AB0006413, DB-005373, KB-223311, TR-016148, 4CH-007226, A6764, AM20060618, FT-0600594, FT-0620161, ST24027572, ST50308168, W6089, EN300-49939, A-1877, 432B846, Z1245537965, 2-(5-bromo-1H-indol-3-yl)acetic acid;(5-Bromo-1H-indol-3-yl)-aceticacid, 2SX
ID: 3051
InChIKey: WTIFWNIVNWDXEU-DEDYPNTBSA-N
SMILES: C(/C(=N/NC(C1=CC=CC=C1)=O)/C)1C(C)=NN(C2=CC=CC=C2)C1=O
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3052
InChIKey: WUYAXFIMCSEVKJ-UHFFFAOYSA-N
SMILES: C12C=CC=CC=1C=CC1C(=O)C=C(C3=CC=CC(C(F)(F)F)=C3)OC2=1
biological descriptors:
CFTR relevance: effective CFTR activator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3053
InChIKey: WVGUWJOVXKGXTK-UHFFFAOYSA-N
SMILES: C1=CC=C(OC)C(OC)=C1C1CC(C2=C(O)C=CC=C2O)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3054
InChIKey: XBRXTFQPRLTHEH-UHFFFAOYSA-N
SMILES: C1(=NC=CC=C1)C1C=C(CNC(=O)OCCC)ON=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3055
InChIKey: XCSAVBFMRKLAMV-UHFFFAOYSA-N
SMILES: C(C(=O)CC)1=CC=CC=C1OC(=O)C1=CC=C([NH0+](=O)[OH0-])C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3056
InChIKey: XEJBWGUOABDGLH-UHFFFAOYSA-N
SMILES: C(C(F)(F)F)1=CC=C(C(=O)OC2=CC(OC(=C)C3=CC=C(C(F)(F)F)C=C3)=C(C(=O)C)C=C2)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3057
InChIKey: XGJKADGASPPCCX-UHFFFAOYSA-N
SMILES: C1=CC(OC)=CC(OC)=C1C1CC(C2=C(O)C=CC=C2)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: CFTR potentiator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3058
InChIKey: XHTUCAIJRJPWQS-UHFFFAOYSA-N
SMILES: C12C3=NOCC3CCC1=NN(C1=CC=CC=C1)C2OC
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3059
InChIKey: XJSGHOOFABZHRF-IFMALSPDSA-N
SMILES: COc1ccc2c(c1)O[C@H](C[C@H]2NC(=O)C3(CC3)c4ccc5c(c4)OC(O5)(F)F)c6ccc(cc6)C(=O)O
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301334
synonyms found at PubChem are:
SCHEMBL17709026, XJSGHOOFABZHRF-IFMALSPDSA-N, 4-[(2R,4R)-4-({[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl]carbonyl}amino)-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzoic acid
ID: 3060
InChIKey: XOQDICYZWFFYGC-UHFFFAOYSA-N
SMILES: C1=CC=C(OC)C(OC)=C1C1CC(C2=C(O)C=CC(C)=C2)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3061
InChIKey: XQPNCZDPZRCEHB-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C2C(=NC(=N1)N)CNC(=O)C3=C2C(=C(N3)Br)Br
biological descriptors:
CFTR relevance: CFTR Trafficking Corrector, PARP inhibitor
Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment ER & Golgi (Translation, quality control, trafficking, PTM)
reference list:
"RM Centko"
"KA Teske"
"RG Linington"
"J Liao"
"R Robert"
"D Zhang"
"RJ Andersen"
"JW Hanrahan"
"SM Anjos"
"L Yan"
"RA Keyzers"
"DY Thomas"
"GW Carlile"
"CA Gray"
"DE Williams"
"HM Sampson"
CID is 25168133
synonyms found at PubChem are:
SCHEMBL13042344
ID: 3062
InChIKey: YAZWGQPBZYRJOI-UHFFFAOYSA-N
SMILES: C2=C(C=C1C=C(C(=NC1=C2)N3CCN(CC3)C(C4=C(C=CC=C4)Cl)=O)C#N)OC.CC
biological descriptors:
CFTR relevance: CFTR potentiator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment
reference list:
"AB Wood"
"PW Phuan"
"AS Verkman"
"JM Knapp"
"GL Lukacs"
"B Yang"
"MJ Kurth"
ID: 3063
InChIKey: YCMVNNBTUGGHDO-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C(CC(O2)c3ccccc3Cl)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301285
synonyms found at PubChem are:
SCHEMBL17708971
ID: 3064
InChIKey: YQPMMCSWGHFWEY-UTINFBMNSA-N
SMILES: N(CCC=C)1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)C1
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"V Cendret"
"T Legigan"
"M Forcella"
"P Parenti"
"I Adachi"
"C Norez"
"S Thibaudeau"
"J Désiré"
"F Becq"
"Y Blériot"
"A Mingot"
"A Kato"
"J Bertrand"
ID: 3065
InChIKey: YWPPDWBQKYEYCU-UHFFFAOYSA-N
SMILES: C1=CC=C(OC)C(OC)=C1C1CC(C2=C(O)C=CC=C2)=NN1C1=CC=C(S(N)(=O)=O)C=C1
biological descriptors:
CFTR relevance: CFTR potentiator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment
reference list:
"S Jo"
"S Kumar"
"PK Sharma"
"HK Lee"
"J Park"
"W Namkung"
"DK Jeon"
"P Khloya"
"Y Seo"
ID: 3066
InChIKey: YXSQRBVTVVVHEQ-UHFFFAOYSA-N
SMILES: C1CNC(=O)C2[NH0]C(Br)=C(Br)C=2C=1
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3067
InChIKey: ZBAIIYYJTYBJCO-UHFFFAOYSA-N
SMILES: C1(=CC=CC=C1OC)C1C=C(CN(C(C)C)CCC(=O)OC)ON=1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3068
InChIKey: ZDIQSOCBAFPKHR-UHFFFAOYSA-N
SMILES: C1=CC=CC2C=CC(C(=O)C)=C(OC(=O)C3=CC=CC=C3I)C1=2
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3069
InChIKey: ZIEPEWXOOMYMCQ-UHFFFAOYSA-N
SMILES: C2=CC=C1C=C(C(=NC1=C2C)NCCNC(NC3=CC=CC=C3OCC)=S)C#N.CC
biological descriptors:
CFTR relevance: CFTR potentiator
Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment
reference list:
"AB Wood"
"PW Phuan"
"AS Verkman"
"JM Knapp"
"GL Lukacs"
"B Yang"
"MJ Kurth"
ID: 3070
InChIKey: ZKUDXIBQPONYCY-UHFFFAOYSA-N
SMILES: C(C(=O)CC)1=CC=CC=C1OC(=O)C1=C(I)C=CC=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3071
InChIKey: ZMAQFJHAVRILQP-UHFFFAOYSA-M
SMILES: [NH0+](C(C1=CC=CC=C1)CO)1C=C2C=CC=CC2=CC=1.CCCCCCCCCCCCOS(=O)(=O)[OH0-]
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
CID is 85173603
ID: 3072
InChIKey: ZOZLJFXFSKTQIQ-BZNPZCIMSA-N
SMILES: N(CCC(F)(F)C)1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)C1
biological descriptors:
CFTR relevance: Non-effective CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
reference list:
"V Cendret"
"T Legigan"
"M Forcella"
"P Parenti"
"I Adachi"
"C Norez"
"S Thibaudeau"
"J Désiré"
"F Becq"
"Y Blériot"
"A Mingot"
"A Kato"
"J Bertrand"
ID: 3073
InChIKey: ZQUKOPGOGYBHSM-TZIWHRDSSA-N
SMILES: c1cc(cc(c1)C(=O)O)[C@H]2C[C@H](c3ccc(cc3O2)C(F)(F)F)NC(=O)C4(CC4)c5ccc6c(c5)OC(O6)(F)F
biological descriptors:
CFTR relevance: CFTR corrector
Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown
CID is 121301270
synonyms found at PubChem are:
SCHEMBL17708955, ZQUKOPGOGYBHSM-TZIWHRDSSA-N, 3-[(2R,4R)-4-({[1-(2,2-difluoro-1,3-benzodioxol-5-yl)cyclopropyl]carbonyl}amino)-7-(trifluoromethyl)-3,4-dihydro-2H-chromen-2-yl]benzoic acid
ID: 3074
InChIKey: ZTTHLXXJDFDDCO-UHFFFAOYSA-N
SMILES: C1CNC(=O)C2[NH0]C=CC=2C=1
biological descriptors:
CFTR relevance: unspecified
Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown
reference list:
"R Andersen"
"JW Hanrahan"
"CM Edge"
"R Hatley"
"R Robert"
"E Matthes"
"DY Thomas"
"GW Carlile"
"R Solari"
"Q Yang"
"V Birault"
ID: 3075
InChIKey: ZYQUNSPONPGRBK-UHFFFAOYSA-N
SMILES: C(F)1=CC=C(C(=O)OC2=CC(OC(=C)C3=CC=C(F)C=C3)=C(C(=O)C)C=C2)C=C1
biological descriptors:
CFTR relevance: inactive
Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown
reference list:
"EJ Niedzinski"
"K By"
"M Eda"
"MF Springsteel"
"AS Verkman"
"MJ Haddadin"
"LJ Galietta"
"MH Nantz"
"MJ Kurth"
ID: 3076
InChIKey: ALYNCZNDIQEVRV-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1C(=O)O)N
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 978
synonyms found at PubChem are:
4-aminobenzoic acid, 150-13-0, p-aminobenzoic acid, PABA, para-aminobenzoic acid, Vitamin BX, AMINOBENZOIC ACID, p-Carboxyaniline, 4-Carboxyaniline, Sunbrella, Benzoic acid, 4-amino-, p-Carboxyphenylamine, Hachemina, Paraminol, 1-Amino-4-carboxybenzene, Pabacyd, Pabafilm, Pabamine, Paranate, Amben, Potaba, Romavit, Bacterial vitamin H1, Vitamin H', Anticanitic vitamin, Chromotrichia factor, RVPaba Lipstick, Papacidum, Rvpaba, Trichochromogenic factor, Anti-chromotrichia factor, Super Shade by Coppertone, Benzoic acid, p-amino-, Acidum paraminobenzoicum, ABEE, Pabagel, Pabanol, 4-AMINO-BENZOIC ACID, Caswell No. 033B, Kyselina p-aminobenzoova, MFCD00007894, Vitamin H1, p-Aminobenzoesaeure, 4-Aminobenzoesaeure, 4-aminobenzoic-acid, 4-Carboxyphenylamine, Acido p-aminobenzoico, PAB, gamma-Aminobenzoic acid, benzoic acid, 4-amino, Acido p-aminobenzoico [Italian], UNII-TL2TJE8QTX, Kyselina p-aminobenzoova [Czech], para-aminobenzoate, Anticantic vitamin, EPA Pesticide Chemical Code 233300, BRN 0471605, p-amino benzoic acid, p-amino-Benzoic acid, CHEBI:30753, AI3-02436, TL2TJE8QTX, Aminobenzoic acid (USP), Aminobenzoic acid [USP], .gamma.-Aminobenzoic acid, Aniline-4-carboxylic acid, CHEMBL542, 4-Aminobenzoic acid, 99%, H-4-ABZ-OH, AMINOBENZOIC ACID, PARA, NCGC00091051-01, 4-aminobenzoicacid, DSSTox_CID_4466, DSSTox_RID_77411, DSSTox_GSID_24466, CAS-150-13-0, SMR000471833, CCRIS 6209, HSDB 6840, NSC 7627, EINECS 205-753-0, Actipol, p-carboxy aniline, p-aminobezoic acid, gamma-Aminobenzoate, 4-aminobezoic acid, Trochromogenic factor, Aniline-4-carboxylate, 161406-19-5, 4-Amino benzoic acid, 4-(amino)benzoic acid, Antichromotrichia factor, PubChem13422, Spectrum_000036, RVPaba lipstick (TN), P-AMINO-BENZOATE, Spectrum2_000123, Spectrum3_000294, Spectrum4_000142, Spectrum5_000778, Tetracaine EP Impurity A, P-Aminobenzoic Acid,(S), ACMC-209d3t, bmse000066, bmse000887, bmse000916, Epitope ID:115017, H-(4)Abz-OH, AMINOBENZOIC-4 ACID, EC 205-753-0, SCHEMBL8249, Oprea1_221096, BSPBio_001828, KBioGR_000584, KBioSS_000396, ZINC920, MLS001066325, MLS001335919, MLS001335920, Para Amino Benzoic Acid USP, BIDD:ER0375, DivK1c_000783, SPBio_000166, PARA AMINO BENZOIC ACID, 4-Aminobenzoic acid-[13C6], RARECHEM AL BO 0238, component of Presun (Salt/Mix), DTXSID6024466, SCHEMBL13232108, KBio1_000783, KBio2_000396, KBio2_002964, KBio2_005532, KBio3_001328, NSC7627, NINDS_000783, OTAVA-BB 1509951, P-AMINOBENZOIC ACID 100G, 150-13-0 4-aminobenzoic acid, HMS2269E10, HMS3870E13, LABOTEST-BB LTBB000459, WT266, ACT09225, HY-B1008, NSC-7627, Tox21_111069, Tox21_201702, Tox21_300087, ANW-21255, BDBM50145829, LABOTEST-BB LT03328355, s4510, SBB058665, STK397441, AKOS000118983, Tox21_111069_1, AC-8107, AM86626, AS00762, CCG-266139, CS-4505, DB02362, MCULE-3535374816, IDI1_000783, 4-Aminobenzoic acid, analytical standard, NCGC00091051-02, NCGC00091051-03, NCGC00091051-04, NCGC00253923-01, NCGC00259251-01, AK-41178, AS-12493, NCI60_041683, SY003749, SBI-0051277.P003, DB-028695, 4-Aminobenzoic acid, ReagentPlus(R), 99%, A0269, FT-0617557, ST50632536, 4-Aminobenzoic acid, >=98.0% (HPLC/NT), 3297-EP2308861A1, 3297-EP2308868A1, 3297-EP2311809A1, 4-Aminobenzoic acid, ReagentPlus(R), >=99%, 6761-EP1441224A2, 6761-EP2295402A2, C00568, D02456, Q-9193, 48316-EP2281563A1, 48316-EP2308874A1, 48316-EP2311494A1, Q284959, 4-Aminobenzoic acid, Vetec(TM) reagent grade, 98%, Q-200432, 4-Aminobenzoic acid, purified by sublimation, >=99%, Z57127446, 4-Aminobenzoic acid, 98.5-100.2%, SAJ first grade, 4-Aminobenzoic acid, SAJ special grade, 99.5-100.2%, F2191-0259, 4A5E7DD8-8A22-4642-86BF-05B778C0C78E, 4-Aminobenzoic acid, European Pharmacopoeia (EP) Reference Standard, Aminobenzoic acid, United States Pharmacopeia (USP) Reference Standard, Aminobenzoic Acid, Pharmaceutical Secondary Standard; Certified Reference Material
ID: 3077
InChIKey: AOJJSUZBOXZQNB-UHFFFAOYSA-N
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 1691
synonyms found at PubChem are:
7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione, NSC169534, 56420-45-2, DOXORUBICIN HYDROCHLORIDE LIPOSOME, Triferric doxorubicin, Adriamycin semiquinone, GNF-Pf-2453, 5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, (8S,10S)-, 7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,9,11-trihydroxy-9-(2-hydroxy-1-oxoethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione, NCI-C01514, FI 106, NSC-169534, 5, 10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, (8S-cis)-, mixt. with native calf thymus DNA, NDC 38242-874, ADR (Salt/Mix), Adriamycin Fe3Cl10 H, DOX HCl (Salt/Mix), NSC-123127, NSC-267703, Neuro_000057, Neuro_000121, Adriamycin-DNA hydrochloride, SCHEMBL233853, CHEMBL263733, CHEBI:91872, 3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside, ADM, Adriamycin hydrochloride (Salt/Mix), Doxorubicin hydrochloride (Salt/Mix), FI-106, NSC267703, NSC272332, NSC272707, NSC272708, NSC302662, NSC303830, NSC303831, NSC307242, NSC307243, NSC321796, STK397071, STL484194, AKOS005434002, MCULE-1987806380, NSC-272332, NSC-272707, NSC-272708, NSC-302662, NSC-303830, NSC-303831, NSC-307242, NSC-307243, NSC-321796, FT-0601614, FT-0630692, FT-0656147, BRD-A76941896-001-01-6, BRD-A76941896-003-01-2, BRD-A76941896-003-02-0, Q27163668, (8S,10S)-10-[(3-Amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-8-glycoloyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione, 3,6,11-trihydroxy-3-(hydroxyacetyl)-10-methoxy-5,12-dioxo-1,2,3,4,5,12-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside, 3-Glycoloyl-1,2,3,4,6,11-hexahydro-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1-naphthacenyl 3-amino-2,3,6-trideoxy-L-lyxo-hexopyranoside, (1S,3S)-, 3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-naphthacenyl 3-amino-2,3,6-trideoxyhexopyranoside, 5, 10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, hydrochloride, (8S-cis)-, polymer with starch 2-hydroxyethyl ether, 5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, (8S-cis)-, Aluminate(1-), hydrogen, compd. with (8S-cis)-10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione (1:1), Cellulose, polymer with (8S-cis)-10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione, Dextran,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione, Ferrate (1-),3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione]decachlorotri-, hydrogen, (8S-cis), Ferrate(1-),3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione]decachlorotri-, hydrogen, (8S-cis)-, Nucleic acid, sodium salt, compd. with (8S-cis)-10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione hydrochloride, Nucleic acid, sodium salt, compound with (8S-cis)-10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione hydrochloride, Starch, polymer with (8S-cis)-10-[(3-amino-2,3,6-trideoxy-.alpha.-L-lyxo-hexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione
ID: 3079
InChIKey: CCUBJOCYQZTYNE-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(N(C2(CCCCC2))CCO)SC=3))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155553069
synonyms found at PubChem are:
CHEMBL4544312, BDBM50506065
ID: 3080
InChIKey: DBGTUHVUTOSJOJ-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(NC2(=CC(C(=O)O)=CC=C2))SC=3))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155535344
synonyms found at PubChem are:
CHEMBL4471507, BDBM50506077
ID: 3081
InChIKey: DZTWMQXAKJUHAQ-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCCC(=O)O)SC=2))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155518838
synonyms found at PubChem are:
CHEMBL4446939, BDBM50506067
ID: 3082
InChIKey: FNPXMHRZILFCKX-UHFFFAOYSA-N
SMILES: CCC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)OC(=O)OCC
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 52421
synonyms found at PubChem are:
PREDNICARBATE, 73771-04-7, [2-[(8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate, SCHEMBL1650745, BCP33443, CP0118, AKOS015896518, Hoe 777; Hoe-777;Dermatop;Regemt, DB-055800, FT-0630823, 2-[(4-FLUOROBENZOYL)AMINO]-3-(1H-INDOL-3-YL)PROPANOICACID, [2-(17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] propanoate
ID: 3083
InChIKey: GHTGYZMBQPXTCQ-UHFFFAOYSA-N
SMILES: CC1(CC2=C(C(O1)(C)C)SC(=C2C(=O)N)NC(=O)C3=CC=NN3)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"TC Hwang"
"K Conrath"
"L Qiu"
"Y Sohma"
"HI Yeh"
"X Zou"
CID is 117857370
synonyms found at PubChem are:
GLPG1837, 1654725-02-6, N-(3-carbamoyl-5,5,7,7-tetramethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)-1H-pyrazole-3-carboxamide, GLGP1837, CHEMBL4075348, SCHEMBL16444982, GLPG 1837, BCP23611, EX-A1819, BDBM50246760, s8698, ABBV-974; GLPG-1837, GLPG-1837(ABBV-974), CCG-268014, BS-15598, HY-111099, AK00778999, CS-0034220, EC-000.2515, Q29207083, CC1(C)Cc2c(sc(NC(=O)c3ccn[nH]3)c2C(N)=O)C(C)(C)O1, LJP
ID: 3084
InChIKey: IAKHMKGGTNLKSZ-UHFFFAOYSA-N
SMILES: CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 2833
synonyms found at PubChem are:
64-86-8, Colchine, (R/S)-Colchicine, CHEBI:23359, (S)-(-)-colchicine, 209810-38-8, N-(1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide, 54192-66-4, Acetamide,N-[(7S)-5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl]-, COLCHICINE, (+)-, Acetamide, N-(5,6,7,9-tetrahydro-1,2,3,10-tetramethoxy-9-oxobenzo[a]heptalen-7-yl)-, (S)-, Colchicine-[d3], CHEMBL87, (S)-Colchicine >95%, (+-)-COLCHICINE, Epitope ID:141498, Neuro_000002, MLS001181527, SCHEMBL675246, DTXSID20274387, HMS2875H17, HMS3267B14, HMS3414L21, HMS3678L19, BCP09065, AC-281, BBL010108, CC0177, CCG-46868, SBB079703, STK801462, AKOS003381878, AKOS016374434, DB01394, MCULE-7902106432, NE55304, NCGC00094629-01, NCGC00094629-02, NCGC00094629-03, NCGC00094629-04, NCGC00094629-05, NCGC00094629-06, NCGC00094629-08, AS-14691, M205, SMR000567246, ST056390, DB-054740, FT-0665155, FT-0665156, AB00830494-06, 064T868, Q326224, J-013744, SR-01000636539-1, BRD-A46684810-001-04-6, Z1431321925, 1,2,3,10-Tetramethoxy-7-(acetylamino)-5,6,7,9-tetrahydrobenzo[a]heptalene-9-one, Benzo[a]heptalen-9(5H)-one,7-acetamido-6,7-dihydro-1,2,3,10-tetramethoxy-, N-((7S)-1,2,3,10-tetramethoxy-9-oxo-5,6,7-trihydrobenzo[d]heptalen-7-yl)acetam ide, N-(1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamide, N-(1,2,3,10-Tetramethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide #, N-(1,2,3,10-tetramethoxy-9-oxo-5,6,7-trihydrobenzo[d]heptalen-7-yl)acetamide, 2,2,2-trideuterio-N-[(7S)-1,2,3-trimethoxy-9-oxo-10-(trideuteriomethoxy)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide, N-{3,4,5,14-tetramethoxy-13-oxotricyclo[9.5.0.0?,?]hexadeca-1(16),2(7),3,5,11,14-hexaen-10-yl}acetamide, N-{3,4,5,14-tetramethoxy-13-oxotricyclo[9.5.0.0^{2,7}]hexadeca-1(16),2,4,6,11,14-hexaen-10-yl}acetamide
ID: 3085
InChIKey: IGEOJNMYRZUKIK-IBGZPJMESA-N
SMILES: C[C@H]1CC(N(C1)C2=C(C=CC(=N2)N3C=CC(=N3)OCCC4(CC4)C(F)(F)F)C(=O)NS(=O)(=O)C5=CC=CC=C5)(C)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"E Tullis"
"CM McKee"
"F Xuan"
"MA Mall"
"G Marigowda"
"EF McKone"
"D Waltz"
"BW Ramsey"
"SM Rowe"
"SM Moskowitz"
"JL Taylor-Cousar"
"J Savage"
CID is 134393443
synonyms found at PubChem are:
Bamocaftor, VX-659, 2204245-48-5, VX659, UNII-8C7XEW3K7S, 8C7XEW3K7S, Bamocaftor (USAN), Bamocaftor [USAN], (S)-N-(phenylsulfonyl)-6-(3-(2-(1-(trifluoromethyl)cyclopropyl)ethoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethylpyrrolidin-1-yl)nicotinamide, VX 659 pound>>VX659, CHEMBL4297849, SCHEMBL20023905, GTPL10553, BCP29456, EX-A2947, WHO 11167, DB15177, compound 1 [WO2018064632A1], D11535, 3-Pyridinecarboxamide, N-(phenylsulfonyl)-6-(3-(2-(1-(trifluoromethyl)cyclopropyl)ethoxy)-1H-pyrazol-1-yl)-2-((4S)-2,2,4-trimethyl-1-pyrrolidinyl)-, N-(benzenesulfonyl)-6-[3-[2-[1-(trifluoromethyl)cyclopropyl]ethoxy]pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide, N-(phenylsulfonyl)-6-(3-(2-(1-(trifluoromethyl)cyclopropyl)ethoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethyl-1-pyrrolidinyl)nicotinamide
ID: 3086
InChIKey: JCRJFYZSIFGDIG-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCO)SC=2))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155565175
synonyms found at PubChem are:
CHEMBL4580215, BDBM50506060
ID: 3087
InChIKey: JIMHYXZZCWVCMI-UHFFFAOYSA-N
SMILES: C1=CC(=CC(=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(=O)O)SC2=S)C(F)(F)F
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"M Gentzsch"
"IG Chaudhry"
"R Schlegel"
"SH Randell"
"SE Boyles"
"C Cho"
"H Dang"
"C Cheluvaraju"
"NL Quinney"
"X Liu"
CID is 504670
synonyms found at PubChem are:
CFTRinh-172, CFTR(inh)-172, 307510-92-5, 4-[[4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene]methyl]benzoic acid, 4-({4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene}methyl)benzoic acid, CBMicro_044684, (inh)-172, SCHEMBL919042, GTPL4153, CHEBI:131686, HMS3653A11, 4-[(Z)-[4-oxo-2-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-5-ylidene]methyl]benzoic acid, BCP15834, MCULE-9803633016, AK391459, FT-0677541, cystic fibrosis transmembrane regulator inhibitor 172, Q27075883, Cystic fibrosis transmembrane conductance regulator inhibitor CFTR(inh)-172, 3-[(3-trifluoromethyl)phenyl]-5-[(3-carboxyphenyl)methylene]-2-thioxo-4-thiazolidinone, 4-[[4-oxo-2-thioxo-3-[3-(trifluoromethyl)phenyl]-5-thiazolidinylidene]methyl]-benzoic acid
ID: 3088
InChIKey: JWENNUJIMLMAJH-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NC(=O)C=C)SC=2))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155528709
synonyms found at PubChem are:
CHEMBL4461468, BDBM50506070
ID: 3089
InChIKey: KHNUPLUQJFLSLN-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(N(C2(=CC(C(=O)C)=CC=C2))CCO)SC=3))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155560887
synonyms found at PubChem are:
CHEMBL4574818, BDBM50506073
ID: 3090
InChIKey: MBMBGCFOFBJSGT-UHFFFAOYSA-N
SMILES: CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)O
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"GE Rovati"
"M Aiello"
"E Clini"
"A Sala"
"E Teopompi"
"G Pisi"
"C Buccellati"
"P Risé"
"C Tripodi"
"V Fainardi"
"A Chetta"
"R Pisi"
CID is 3144
synonyms found at PubChem are:
6217-54-5, DHA;Cervonic Acid, cis-4,7,10,13,16,19-Docosahexaenoic acid, 4,7,10,13,16,19-Docosahexaenoic acid, (4Z,7Z,10Z,13Z,16Z,19Z)-, 124020-09-3, cis-4,7,13,16,19-docosahexaenoic acid, 4,7,10,13,16,19-Docosahexaenoic acid, ACMC-20mqw5, ACMC-209n0b, CBiol_001946, KBioGR_000018, KBioSS_000018, KBio2_000018, KBio2_002586, KBio2_005154, KBio3_000035, KBio3_000036, Bio1_000232, Bio1_000721, Bio1_001210, Bio2_000018, Bio2_000498, ANW-34089, 4,7,10,13,16,19-Docosahexaenoicacid, (4Z,7Z,10Z,13Z,16Z,19E)-, AKOS028109045, 4,7,10,13,16,19-docosahexenoic acid, DB-054085, FT-0623913, FT-0667760, 4Z,7Z,10Z,13Z,16Z,19Z-DOCOSAHEXAENOIC-21,21,22,22,22-D5 ACID
ID: 3091
InChIKey: MJUVRTYWUMPBTR-MRXNPFEDSA-N
SMILES: CC(C)(CO)C1=CC2=CC(=C(C=C2N1C[C@H](CO)O)F)NC(=O)C3(CC3)C4=CC5=C(C=C4)OC(O5)(F)F
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"D Grenet"
"A Carsin"
"N Stremler-Le Bel"
"JP Jais"
"F Le Pimpec-Barthes"
"M Mesbahi"
"P Bonnette"
"V Urbach"
"J Simonin"
"IM Pranke"
"A Hatton"
"M Fayon"
"E Girodon-Boulandet"
"M Thumerel"
"I Sermet-Gaudelus"
"A Edelman"
"A Hinzpeter"
"J Mazenq"
CID is 46199646
synonyms found at PubChem are:
Tezacaftor, VX-661, 1152311-62-0, (R)-1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(1-(2,3-dihydroxypropyl)-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)-1H-indol-5-yl)cyclopropanecarboxamide, Tezacaftor (VX-661), VX661, VX 661, UNII-8RW88Y506K, 8RW88Y506K, cyclopropanecarboxamide, 1-(2,2-difluoro-1,3-benzodioxol-5-yl)-n-[1-[(2r)-2,3-dihydroxypropyl]-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1h-indol-5-yl]-, C26H27F3N2O6, Tezacaftor [USAN], 1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-[1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)indol-5-yl]cyclopropane-1-carboxamide, 1-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)-N-{1-[(2R)-2,3-DIHYDROXYPROPYL]-6-FLUORO-2-(1-HYDROXY-2-METHYLPROPAN-2-YL)INDOL-5-YL}CYCLOPROPANE-1-CARBOXAMIDE, Cyclopropanecarboxamide, 1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-(1-((2R)-2,3-dihydroxypropyl)-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl)-, Tezacaftor (USAN/INN), SCHEMBL322362, VX 661;VX661;Tezacaftor, CHEMBL3544914, SCHEMBL10034144, GTPL10199, DTXSID40673070, BDBM281054, BCP07173, EX-A1759, MFCD23106064, s7059, US10022352, Compound 315, ZINC68206930, CCG-269854, CS-1078, DB11712, PB30512, 1-(2,2-Difluoro-2H-1,3-benzodioxol-5-yl)-N-{1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)-1H-indol-5-yl}cyclopropane-1-carboxamide, AC-32773, AK172569, AS-35211, HY-15448, QC-11636, example 315 [US20090131492A1], SW219937-1, Y0430, D11041, Q-4067, Q27270940, (R)-1 (2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(1-(2,3-dihydroxypropyl)-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)-1H-indol-5-yl)cyclopropanecarboxamide, (R)-1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(1-(2,3-dihydroxypropyl)-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)-1H-indol-5-yl)cyclopropane-1-carboxamide, 1-(2,2-difluoro-1,3-benzodioxol-5-yl)-~{N}-[1-[(2~{R})-2,3-dihydroxypropyl]-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)indol-5-yl]cyclopropane-1-carboxamide, 1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-(1-((2R)-2,3-dihydroxypropyl)-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl)cyclopropanecarboxamide, 1-(2,2-Difluoro-1,3-benzodioxol-5-yl)-N-[1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl]-cyclopropanecarboxamide
ID: 3092
InChIKey: MJUVRTYWUMPBTR-UHFFFAOYSA-N
SMILES: CC(C)(CO)C1=CC2=CC(=C(C=C2N1CC(CO)O)F)NC(=O)C3(CC3)C4=CC5=C(C=C4)OC(O5)(F)F
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"G Cui"
"A Rab"
"NA McCarty"
"JS Hong"
"BR Imhoff"
"BB Stauffer"
"EJ Sorscher"
"CM Farinha"
"JD Santos"
"P Jordan"
"P Matos"
"CA Loureiro"
"FR Pinto"
"AM Matos"
"E Tullis"
"CM McKee"
"F Xuan"
"MA Mall"
"G Marigowda"
"EF McKone"
"D Waltz"
"BW Ramsey"
"SM Rowe"
"SM Moskowitz"
"JL Taylor-Cousar"
"J Savage"
"A Moeller"
"LT Wang"
"J Lekstrom-Himes"
"EP Ingenito"
"Y Lu"
"JS Elborn"
"C McKee"
"EF McKone"
"C Simard"
"JL Taylor-Cousar"
"CK van der Ent"
"A Munck"
"K Montemayor"
"NE West"
"MS Christianson"
"N Lechtzin"
"S Carson"
"AT Claudio"
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
"Group. VX11-661-101 Study"
"LT Wang"
"M Griese"
"SH Donaldson"
"E Tullis"
"JM Pilewski"
"J Cooke"
"L Viswanathan"
"JC Davies"
"JA Lekstrom-Himes"
CID is 46199801
synonyms found at PubChem are:
Tezacaftor (Racemate), SCHEMBL322363, HMS3652D20, HMS3748O05, AKOS026750399, NCGC00389346-01, 1-(2,2-difluorobenzo[d][1,3]dioxol-5-yl)-N-(1-(2,3-dihydroxypropyl)-6-fluoro-2-(1-hydroxy-2-Methylpropan-2-yl)-1H-indol-5-yl)cyclopropanecarboxaMide, 1226709-85-8, DA-47741, CS-0009162, FT-0772351, 1-(2,2-DIFLUORO-1,3-BENZODIOXOL-5-YL)-N-[1-(2,3-DIHYDROXYPROPYL)-6-FLUORO-2-(1-HYDROXY-2-METHYLPROPAN-2-YL)INDOL-5-YL]CYCLOPROPANE-1-CARBOXAMIDE
ID: 3093
InChIKey: MVRHVFSOIWFBTE-INIZCTEOSA-N
SMILES: C[C@H]1CC(N(C1)C2=C(C=CC(=N2)N3C=CC(=N3)OCC(C)(C)C(F)(F)F)C(=O)NS(=O)(=O)C4=CN(N=C4C)C)(C)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"E Tullis"
"CM McKee"
"F Xuan"
"MA Mall"
"G Marigowda"
"EF McKone"
"D Waltz"
"BW Ramsey"
"SM Rowe"
"SM Moskowitz"
"JL Taylor-Cousar"
"J Savage"
CID is 134587348
synonyms found at PubChem are:
Elexacaftor, 2216712-66-0, VX-445, UNII-RRN67GMB0V, RRN67GMB0V, Elexacaftor (USAN), Elexacaftor [USAN], (S)-N-((1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethylpyrrolidin-1-yl)nicotinamide, 3-Pyridinecarboxamide, N-((1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)-2-((4S)-2,2,4-trimethyl-1-pyrrolidinyl)-, Elexacaftor (VX-445), CHEMBL4298128, SCHEMBL20239811, GTPL10552, EX-A3637, N-(1,3-dimethylpyrazol-4-yl)sulfonyl-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide, s8851, WHO 11180, DB15444, Compound 1 [WO2018107100A1], HY-111772, CS-0090942, D11507
ID: 3094
InChIKey: MVRHVFSOIWFBTE-UHFFFAOYSA-N
SMILES: CC1CC(N(C1)C2=C(C=CC(=N2)N3C=CC(=N3)OCC(C)(C)C(F)(F)F)C(=O)NS(=O)(=O)C4=CN(N=C4C)C)(C)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"K Montemayor"
"NE West"
"MS Christianson"
"N Lechtzin"
"S Carson"
"AT Claudio"
CID is 134606452
synonyms found at PubChem are:
SCHEMBL20261106, (R)-N-((1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethylpyrrolidin-1-yl)nicotinamide, BCP29711, N-(1,3-dimethylpyrazol-4-yl)sulfonyl-6-[3-(3,3,3-trifluoro-2,2-dimethylpropoxy)pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
ID: 3095
InChIKey: NTZREEWWCNFIMJ-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NC(=O)CC)SC=2))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155561108
synonyms found at PubChem are:
CHEMBL4566690, BDBM50506071
ID: 3096
InChIKey: OJTQULAMLNBGOY-UHFFFAOYSA-N
SMILES: CC(C(C)OC(=O)C)C(=O)OCC12C3CC(C(C1O)OC2CC4(C3=CCC5C4(CCC6C5(CCC(C6(C)CO)OC7C(C(C(C(O7)C(=O)O)OC8C(C(C(C(O8)CO)O)O)O)O)OC9C(C(C(CO9)O)O)O)C)C)C)(C)C.[Na+]
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 78302531
synonyms found at PubChem are:
Sodium aescinate, Sodium?Aescinate, 20977-05-3
ID: 3097
InChIKey: OUGLISSDQZYBGK-ZHRRBRCNSA-N
SMILES: c1ccc(c(c1)[C@@H](c2cnc(s2)NC(=O)C3(CC3)c4ccc5c(c4)OCO5)N6CC[C@H](C6)O)Cl
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"H Zhang"
"RL Macdonald"
"M Sumiyoshi"
"FE Uhl"
"A Adel"
"A Momen"
"A Meissner"
"SS Bolz"
"JT Kroetsch"
"M Sauvé"
"JC Fares"
"DD Dinh"
"PH Backx"
"M Husain"
"F Matthes"
"WD Foltz"
"L Vanherle"
"H Wan"
"R Aschar-Sobbi"
"SP Heximer"
"FA Malik"
"D Lidington"
CID is 45480521
synonyms found at PubChem are:
SCHEMBL5118601, DTXSID80919020, ZINC116862995, 1-(1,3-benzodioxol-5-yl)-N-[5-[(S)-(2-chlorophenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]cyclopropane-1-carboxamide, 1-(2H-1,3-Benzodioxol-5-yl)-N-{5-[(2-chlorophenyl)(3-hydroxypyrrolidin-1-yl)methyl]-1,3-thiazol-2-yl}cyclopropane-1-carboximidic acid
ID: 3098
InChIKey: PCCRSEBWEGGETI-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"F Van Goor"
"JJ Wine"
"S Hadida"
"RA Frizzell"
"KS Straley"
"M Miller"
"CJ Decker"
"JH Stack"
"PA Negulescu"
"M Ashlock"
"ER Olson"
"PD Grootenhuis"
"J McCartney"
"B Burton"
CID is 1640986
synonyms found at PubChem are:
CHEMBL4176184, N-[5-(2-Chloro-benzyl)-thiazol-2-yl]-2,2-diphenyl-acetamide, N-[5-(2-chlorobenzyl)-1,3-thiazol-2-yl]-2,2-diphenylacetamide, 5325-06-4, Oprea1_174969, Oprea1_394381, SCHEMBL235126, DTXSID00364674, ZINC1908494, BDBM50289535, STK952039, AKOS000627830, N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2,2-diphenylacetamide, MCULE-2251783088, ST50006732, SR-01000401576, SR-01000401576-1, N-[5-(2-Chloro-benzyl)-thiazol-2-yl]-2,2-diphenyl -acetamide, N-{5-[(2-chlorophenyl)methyl](1,3-thiazol-2-yl)}-2,2-diphenylacetamide, 303791-98-2
ID: 3099
InChIKey: PGPPITSUVBAOTE-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCO)SC=2))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 11220250
synonyms found at PubChem are:
CHEMBL4556068, SCHEMBL4528106, BDBM50506069, N-[5-[2-(2-hydroxyethylamino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
ID: 3100
InChIKey: PPTPXEJJDHXBKP-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCC(=O)O)SC=2))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155521426
synonyms found at PubChem are:
CHEMBL4450239, BDBM50506066
ID: 3101
InChIKey: QAVVZXNUWOEKCV-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(N(C2(CCCCC2))C)SC=3))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155526648
synonyms found at PubChem are:
CHEMBL4458933, BDBM50506078
ID: 3102
InChIKey: QJYUHPGRNQQGGG-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(NC2(CCCCC2))SC=3))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 11348293
synonyms found at PubChem are:
CHEMBL4465048, SCHEMBL4523451, BDBM50506074, N-[5-[2-(cyclohexylamino)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
ID: 3103
InChIKey: VMMNKJYKNQCTSD-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(NC2(CCC(C)CC2))SC=3))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155545735
synonyms found at PubChem are:
CHEMBL4529879, BDBM50506068
ID: 3104
InChIKey: VXNBNOYDTNSYQP-UHFFFAOYSA-N
SMILES: [Br]CC(=O)NC=1(SC=C(N=1)C=2(SC(NC(=O)C)=NC=2C))
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155567806
synonyms found at PubChem are:
CHEMBL4590346, BDBM50506072
ID: 3105
InChIKey: WMBWREPUVVBILR-UHFFFAOYSA-N
SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Maiuri"
"VR Villella"
"M Piacentini"
"A Tosco"
"G Kroemer"
"V Raia"
CID is 1287
synonyms found at PubChem are:
TEA polyphenol, 84650-60-2, Gallocatechin gallate, CHEMBL311663, 5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate, [5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate, 107965-88-8, epigallocatechol-3-gallate, (+)-epigallocatechin gallate, SCHEMBL161547, ChEMBL_134784, HMS3393K21, HMS3426I15, HMS3651I16, HMS3868K03, BCP28205, BBL033816, BDBM50093882, STL372995, AKOS025248011, CCG-269314, MCULE-9752626908, NCGC00095722-01, 5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate, AK165605, VS-12292, FT-0604392, FT-0686614, (?)-cis-3,3',4',5,5',7-Hexahydroxy-flavane-3-gallate, (?)-cis-2-(3,4,5-Trihydroxyphenyl)-3,4-dihydro-1(2H)-benzopyran-3,5,7-triol 3-gallate, [5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl] 3,4,5-trihydroxybenzoate, 5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-3-yl 3,4,5-trihydroxybenzoate, 2-(3,4,5-Trihydroxyphenyl)-3-[(3,4,5-trihydroxybenzoyl)oxy]-3,4-dihydro-2H-1-benzopyran-5,7-diol, 3,4,5-Trihydroxy-benzoic acid 5,7-dihydroxy-2-(3,4,5-trihydroxy-phenyl)-chroman-3-yl ester
ID: 3106
InChIKey: WWUPCEYMTCIFHX-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCO)SC=2))C)NC(=O)OC(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155518122
synonyms found at PubChem are:
CHEMBL4445768, BDBM50506064
ID: 3107
InChIKey: XGZWWMRJMWUREF-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCC(=O)O)SC=2))C)NC(=O)C(C)(C)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155561063
synonyms found at PubChem are:
CHEMBL4574879, BDBM50506075
ID: 3108
InChIKey: XTWGHYUHSFTZLL-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(N(C2(CCCCC2))CCO)SC=3))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155511230
synonyms found at PubChem are:
CHEMBL4435663, BDBM50506063
ID: 3109
InChIKey: YKUQEKXHQFYULM-UHFFFAOYSA-N
SMILES: COC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NC4=CC(=C(C(=C4)CN5CCCC5)O)CN6CCCC6.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 156867
synonyms found at PubChem are:
Pyronaridine Tetraphosphate, 76748-86-2, Pyranoridine phosphate, Pyronaridine phosphate, UNII-2T289F9ACO, Pyranoridine tetraphosphate, 2T289F9ACO, MFCD05863545, C29H32ClN5O2.4H3O4P, Pyranaridine tetraphosphate, Phenol, 4-((7-chloro-2-methoxybenzo(b)-1,5-naphthyridin-10-yl)amino)-2,6-bis(1-pyrrolidinylmethyl)-, phosphate (1:4), CHEMBL2095224, DTXSID00998059, HMS3264M16, BCP21166, EX-A2856, 8231AH, HY-14749A, AKOS030255097, AKOS030504480, CCG-213813, MCULE-6402927174, QC-8193, 4-((7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-yl)amino)-2,6-bis(pyrrolidin-1-ylmethyl)phenol tetrakis(phosphate), AT-19508, CS-0028971, Pyronaridine tetraphosphate, >=95% (HPLC), 748P862, Q27255560, 2-Methoxy-7-chloro-10[3',5'-bis(pyrrolidinyl-1-methyl-)4'-hydroxyphenyl]aminobenzyl-(b)-1,5-naphthyridine tetraphosphate, 4-(7-chloro-2-methoxybenzo[b][1,5]naphthyridin-10-ylamino)-2,6-bis(pyrrolidin-1-ylmethyl)phenol tetrakis(phosphate), 4-[(7-chloro-2-methoxy-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis(pyrrolidin-1-ylmethyl)cyclohexa-2,5-dien-1-one,phosphoric acid, Phosphoric acid--4-[(7-chloro-2-methoxy-1,5-dihydrobenzo[b][1,5]naphthyridin-10-yl)imino]-2,6-bis[(pyrrolidin-1-yl)methyl]cyclohexa-2,5-dien-1-one (4/1)
ID: 3110
InChIKey: YPHMISFOHDHNIV-UHFFFAOYSA-N
SMILES: CC1CC(C(=O)C(C1)C(CC2CC(=O)NC(=O)C2)O)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"B Liu"
"JS Hong"
"KM Keeling"
"EL White"
"M Mense"
"H Shang"
"V Mutyam"
"M Du"
"X Xue"
"DM Bedwell"
"F Liang"
"L Rasmussen"
"JR Bostwick"
"MJ Suto"
"M Mazur"
"SM Rowe"
"E Falk Libby"
CID is 2900
synonyms found at PubChem are:
Isocycloheximide, 4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]piperidine-2,6-dione, Acti-Dione, 6746-42-5, Actidione;Naramycin A;CHX, D-Isocycloheximide, Cyclohemimide, Cyclohexamide, Aktidion, Actidione TGF, Caswell No. 504C, 4-(2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)piperidine-2,6-dione, EPA Pesticide Chemical Code 374700, Glutarimide, 3-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]-, (Cycloheximide CHX), (+)-3-(2-(3,5-Dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)glutarimide, Glutarimide, 3-(2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)-, (+)-, CHEMBL225699, MEGxm0_000238, SCHEMBL1714687, 4-[2-(3,5-Dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]-2,6-piperidinedione, ACon0_000589, ACon1_002312, CHEBI:91792, HMS3267I17, Naramycin A; NSC 185;Actidione, 2,6-Piperidinedione, 4-[(2R)-2-[(1S,3S,5S)-3,5-dimethyl-2-oxocyclohexyl]-2-hydroxyethyl]-, ALBB-023622, BCP28121, STL570292, AKOS015900576, MCULE-9492252513, NCGC00169964-01, NCGC00169964-02, NCGC00169964-03, NCGC00169964-04, 17280-60-3, DB-054964, R1151, BRD-A62184259-001-01-0, BRD-A62184259-001-02-8, Q27163592, 3-[2-(3,5-Dimethyl-2-oxocyclohexyl)-2-hydroxyethyl] glutarimide, 2,6-piperidinedione, 4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]-, 3-[(2R)-2-[(1S,3S,5S)-3,5-Dimethyl-2-oxocyclohexyl]-2-hydroxyethyl]glutarimide, NCGC00169964-06!4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]piperidine-2,6-dione, 2,6-Piperidinedione, 4-((2R)-2-((1R,3R,5S)-3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)-, 2,6-Piperidinedione, 4-[2-(3,5-dimethyl-2-oxocyclohexyl)-2-hydroxyethyl]-, [1S-[1.alpha.(S*),3.alpha.,5.beta.]]-, 4-((2R)-2-((1S,3S,5S)-(3,5-Dimethyl-2-oxocyclohexyl)-2-hydroxyethyl)-2,6-piperidinedione
ID: 3111
InChIKey: YQCGOSZYHRVOFW-UHFFFAOYSA-N
SMILES: CC1=C(N=C(C=C1)NC(=O)C2(CC2)C3=CC4=C(C=C3)OC(O4)(F)F)C5=CC(=CC=C5)C(=O)O.CC(C)(C)C1=CC(=C(C=C1NC(=O)C2=CNC3=CC=CC=C3C2=O)O)C(C)(C)C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"AM Lauzon"
"M Pyrch"
"C Wong"
"JG Martin"
"JH Jang"
"MJ O'Sullivan"
"A Panariti"
"GJ Connett"
"E Sage"
"F Becq"
"C Coraux"
"L Froux"
CID is 71494926
synonyms found at PubChem are:
Orkambi, Lumacaftor / Ivacaftor, Lumacaftor and ivacaftor, Lumacaftor and ivacaftor tablet, SCHEMBL19410545, VX 700-VX 809 combination, VX 809-VX 770 combination, Ivacaftor mixture with lumacaftor, Lumacaftor, ivacaftor drug combination, S900006790, 1815566-23-4
ID: 3112
InChIKey: ZAAVGWLFVJKADF-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=3(N=C(N(C2(=CC(C(=O)C)=CC=C2))CCO)SC=3))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155546020
synonyms found at PubChem are:
CHEMBL4531023, BDBM50506062
ID: 3113
InChIKey: ZACBDYXCOJIDOO-UHFFFAOYSA-N
SMILES: S(=O)(=O)(NC=1(SC=C(N=1)C=2(SC(NC(=O)C)=NC=2C)))C=C
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155567860
synonyms found at PubChem are:
CHEMBL4589961
ID: 3114
InChIKey: ZEQRQXRPMGQNBI-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NCCO)SC=2))C)NC(=O)C3(=CC=CC=C3))
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
CID is 155519200
synonyms found at PubChem are:
CHEMBL4447091, BDBM50506076
ID: 3078
InChIKey: BHNLPHFGIMIKBX-UHFFFAOYSA-N
SMILES: S1(C(=NC(=C1C=2(N=C(NC(=O)C=CC(C)C)SC=2))C)NC(=O)C)
biological descriptors:
CFTR relevance: to be classified
Category:
Influence on CFTR function to be classified
Order of interaction to be classified
subcellular compartment to be classified
reference list:
"L Delang"
"E Dreassi"
"G Tagliavini"
"K Lanko"
"C Zamperini"
"M Radi"
"E Crespan"
"S Palese"
"C Mirabelli"
"J Neyts"
"E Langron"
"S Bertoni"
"S Tassini"
"G Maga"
"F Ravanetti"
"L Ragionieri"
"A Mancini"
"C Giorgio"
"G Fontò"
"P Vergani"
"M Kissova"
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