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CandActCFTR used public reference

The following publication reference has been reported to contain CFTR related structural information.
"R Robert" "DY Thomas" "J Liao" "C Pavel" "D Zhang" "GW Carlile" "SM Anjos" "JW Hanrahan" "Y Luo" "N Liu"


Below you will find all the structures identified in the publication. Be warned that this does not imply any activity. n=7

ID: 13
InChIKey: BNRNXUUZRGQAQC-UHFFFAOYSA-N
SMILES: CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment ER & Golgi (Translation, quality control, trafficking, PTM)

chemical graph of compound 13



CID is 5212
synonyms found at PubChem are:
sildenafil, 139755-83-2, Revatio, VIAGRA, Sildenafil [INN:BAN], UK-92480, UNII-3M7OB98Y7H, Aphrodil (TN), Sildenafil (INN), UK-92,480-10, C22H30N6O4S, HSDB 7305, CHEMBL192, 3M7OB98Y7H, CHEBI:9139, UK 92480-10, 1-((3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methylpiperazine, BNRNXUUZRGQAQC-UHFFFAOYSA-N, Caverta, 5-(2-Ethoxy-5-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one, NCX-911, Revatio (TN), Viagra (TN), 1-((3-(6,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methylpiperazine citrate, 5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methyl-1-piperazinylsulfonyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one, 5-{2-(ethyloxy)-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-{2-ETHOXY-5-[(4-METHYLPIPERAZIN-1-YL)SULFONYL]PHENYL}-1-METHYL-3-PROPYL-1H,6H,7H-PYRAZOLO[4,3-D]PYRIMIDIN-7-ONE, Piperazine, 1-((3-(4,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methyl-, SMR000752512, 171599-83-0 (citrate), SR-05000001934, NCGC00159496-02, mysildecard, Aphrodil, Vizarsin, Rhucin, Sildenafil#, 1udt, 1xos, 1-[[3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl]-4-methylpiperazine, 5-(2-ethoxy-5-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazinylsulfonyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo(4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazinylsulfonyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, Rhucin (TN), Spectrum_001555, SpecPlus_000798, AC1L1JUI, Spectrum2_001648, Spectrum3_001892, Spectrum4_000586, Spectrum5_001508, D08KTT, D0Z7ZM, Cambridge id 7030299, SCHEMBL1895, BSPBio_003424, KBioGR_001052, KBioSS_002035, MLS001240224, MLS001304737, MLS006011565, BIDD:GT0352, DivK1c_006894, SPECTRUM1504099, SPBio_001775, GTPL4743, SCHEMBL5795456, SCHEMBL8100377, Jsp002373, DTXSID6023579, BDBM14390, KBio1_001838, KBio2_002035, KBio2_004603, KBio2_007171, KBio3_002927, KS-00000XMX, 2h42, MolPort-002-885-861, HMS1684K08, HMS1922B19, HMS2089M12, HMS2093O17, HMS2233L22, HMS3372N07, HMS3715P17, Sildenafil 1.0 mg/ml in Methanol, ACT02662, BCP05337, AC-938, CCG-21806, CCG-39076, s4684, STL483201, STL483720, ZINC19796168, AKOS008901403, AKOS025397193, CS-1577, DB00203, MCULE-2481702478, NCGC00095099-01, NCGC00095099-02, NCGC00095099-03, NCGC00095099-04, NCGC00370976-03, 5-(2-ethoxy-5-(4-methylpiperazin-1-ylsulfonyl)phenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one, AN-15436, AS-48884, BAS 04213629, BC202768, HY-15025, M901, SC-83326, SMR004703325, SBI-0051920.P002, AB0015440, LS-111655, FT-0601554, C07259, D08514, W-2194, AB00052444-02, AB00052444-03, AB00052444_04, AB00052444_05, 755S832, SR-01000504734, I06-0023, J-007309, SR-01000504734-1, SR-05000001934-1, SR-05000001934-2, BRD-K50128260-001-01-6, BRD-K79759585-001-02-1, BRD-K79759585-048-01-4, 4-((4-Ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydr, Z1522567175, Sildenafil solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, 5-[2-Ethoxy-5-(4-methyl-piperazine-1-sulfonyl)-phenyl]-1-methyl-3-propyl-1,6-dihydro-pyrazolo[4,3-d]pyrimidin-7-one (Sildenafil or Viagra), 5-[2-Ethoxy-5-(4-methyl-piperazine-1-sulfonyl)-phenyl]-1-methyl-3-propyl-1,6-dihydro-pyrazolo[4,3-d]pyrimidin-7-one(Sildenafil), 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-Ethoxy-5-(4-methylpiperazin-1-ylsulfonyl)phenyl]-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-Ethoxy-5-(4-methylpiperazin-1-ylsulfonyl)phenyl]-1-methyl-3-n-propyl-1.6-dihydro-7H-pyrazolo[4,3-d]Pyrimidin-7-one, 5-[2-ethoxy-5-(4-methylpiperazine-1-sulfonyl)phenyl]-1-methyl-3-propyl-1H,4H,7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-Ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1,6-dihydro-1-methyl-3-propyl-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,4-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1H,4H,7H-pyrazolo[4,3-d]pyrimidin-7-one, 5-{2-ethoxy-5-[(4-methylpiperazine-1-)sulfonyl]phenyl}-1-methyl-3-propyl-1H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one

ID: 1143
InChIKey: KBUKUKLNLPJWCO-UHFFFAOYSA-N
SMILES: C1CN(CCN1CCOC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 1143



CID is 2747481
synonyms found at PubChem are:
1-(benzenesulfonyl)-4-(2-phenoxyethyl)piperazine, MixCom1_000005, AC1MCMVR, AC1Q6VJV, Maybridge1_000005, Oprea1_668388, MolPort-001-841-346, ZINC19924752, AKOS008690847, MCULE-4730077666, Z46248350, 876686-44-1

ID: 1250
InChIKey: LCOLXNYRAYSOSS-UHFFFAOYSA-N
SMILES: CC1C2=CC(=C(C=C2CCN1S(=O)(=O)C3=CN(C(=N3)C)C)OC)OC

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 1250



CID is 2812733
synonyms found at PubChem are:
AC1MDKSJ, Oprea1_613690, MLS000850277, AC1Q470D, CHEMBL1715865, MolPort-001-807-960, HMS2781E12, CCG-51849, MCULE-4302786397, 2-(1,2-dimethylimidazol-4-yl)sulfonyl-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline, SMR000456295, SR-01000641125-1, 2-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline, 2-[(1,2-dimethyl-1H-imidazol-4-yl)sulfonyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

ID: 1260
InChIKey: LGBHNNGNTSGBAA-UHFFFAOYSA-N
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3OC

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 1260



CID is 668965
synonyms found at PubChem are:
83863-44-9, 1-(2-Methoxyphenyl)-4-(p-tolylsulphonyl)piperazine, 1-(2-methoxyphenyl)-4-[(4-methylphenyl)sulfonyl]piperazine, 1-(2-methoxyphenyl)-4-(p-tolylsulfonyl)piperazine, EINECS 281-107-1, AC1LDLAA, BAS 00451426, Oprea1_277459, Oprea1_847731, ZINC29412, DTXSID30232756, MolPort-000-556-285, STK071381, AKOS000579076, 1-(2-Methoxyphenyl)-4-tosylpiperazine, MCULE-2377838737, UPCMLD0ENAT5802974:001, ST042463, KB-213254, AG-205/36815005, SR-01000514976, SR-01000514976-1, 1-(2-Methoxy-phenyl)-4-(toluene-4-sulfonyl)-piperazine, 1-(2-methoxyphenyl)-4-(4-methylphenyl)sulfonylpiperazine, A1271/0058149

ID: 712
InChIKey: GIEHIZKCIZLXLF-UHFFFAOYSA-N
SMILES: C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)S(=O)(=O)C4=CC=C(C=C4)Cl

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 712



CID is 1241327
synonyms found at PubChem are:
KM11060, 774549-97-2, KM 11060, KM-11060, 7-chloro-4-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]quinoline, 7-Chloro-4-[4-[4-chlorophenyl)sulfonyl]-1-piperazinyl]quinoline, 7-chloro-4-(4-((4-chlorophenyl)sulfonyl)piperazin-1-yl)quinoline, 7-chloro-4-{4-[(4-chlorobenzene)sulfonyl]piperazin-1-yl}quinoline, 7-chloro-4-{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}quinoline, AC1LOJDH, AC1Q3JAI, D06TCC, Oprea1_790000, GTPL4234, CHEMBL1905600, SCHEMBL15774887, CTK8E8287, KS-00000TTX, DTXSID40361304, MolPort-001-608-277, BCP17185, ZINC1040357, CCG-44815, STK206351, AKOS000424630, CS-5499, MCULE-1021162800, NCGC00378786-01, HY-19970, RT-013447, B7286, KM11060, >=98% (HPLC), SR-01000634629-1, BRD-K32856097-001-01-4, Z31097998, 7-Chloro-4-[4-(4-chloro-benzenesulfonyl)-piperazin-1-yl]-quinoline, 7-chloro-4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]quinoline

ID: 2787
InChIKey: ZCYCZDZSEDMTRV-UHFFFAOYSA-N
SMILES: C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)Cl

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 2787



CID is 703841
synonyms found at PubChem are:
334973-48-7, 4-CHLORO-1-((4-PYRIMIDIN-2-YLPIPERAZINYL)SULFONYL)BENZENE, 2-{4-[(4-chlorophenyl)sulfonyl]piperazino}pyrimidine, 2-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]pyrimidine, 2-{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}pyrimidine, 4-chloro-1-[(4-pyrimidin-2-ylpiperazinyl)sulfonyl]benzene, AC1LDZAN, Cambridge id 7242062, Oprea1_446286, MLS000626846, SCHEMBL5251664, CHEMBL1882279, CTK6H0916, ZINC87272, MolPort-001-545-940, HMS2688D22, CCG-24345, STK441472, AKOS001689286, MCULE-2186472217, MS-7569, KS-0000296C, SMR000299226, ZB003126, ST50927795, AB00040178-01, BRD-K73961382-001-08-1, Z31098000, 2-(4-(4-chlorophenylsulfonyl)piperazin-1-yl)pyrimidine, 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]pyrimidine, 2-{4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl}pyrimidine

ID: 1832
InChIKey: QJRPMZWTWYPYKW-UHFFFAOYSA-N
SMILES: C1CN(CCN1C2=C3C=CC(=CC3=NC=C2)Cl)S(=O)(=O)C4=CC=CC=C4

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

chemical graph of compound 1832



CID is 1241326
synonyms found at PubChem are:
7-chloro-4-[4-(phenylsulfonyl)piperazin-1-yl]quinoline, Maybridge3_004220, 4-[4-(benzenesulfonyl)piperazin-1-yl]-7-chloroquinoline, AC1LOJDE, AC1Q3KOH, Oprea1_139680, MLS000693854, CHEMBL1335718, SCHEMBL15775046, MolPort-001-593-801, HMS1442P18, HMS2650M11, STK171914, ZINC18271087, AKOS000425640, KM11057, MCULE-4594820108, IDI1_015607, SMR000300227, 4-(4-Benzenesulfonyl-piperazin-1-yl)-7-chloro-quinoline, 7-chloro-4-[4-(phenylsulfonyl)-1-piperazinyl]quinoline, 4-[4-(benzenesulfonyl)piperazin-1-yl]-7-chloro-quinoline, 708238-13-5