CFam Chemical Families Database
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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

CFam Family Information

CFAM Family ID CFFID452
Family Name Endothelin-1 receptor Ligand PD156707 Family
No. of Seeds 41 No. of Other Members 211
Family Centroid CFAMM00191784 Functional Category Investigative Drug with Human Metabolite & Natural Product
Superfamily Endothelin-1 receptor Ligand PD156707 Superfamily
Class Class 1606

Cousin Family NamesSeedsMembers
Retinoic acid receptor Ligand naphthoic acid derivative Adapal... 2 264
Acetylcholinesterase Inhibitor Donepezil Family 23 242
Cyclooxygenase Inhibitor Fenoprofen Family 4 1077
DNA topoisomerase 2-beta Inhibitor Etoposide Family 3 29
Prostaglandin G/H synthase 2 Inhibitor Nabumetone Family 4 267
Inosine-5'-monophosphate dehydrogenase 2 Inhibitor Mycophenola... 4 353
Heat shock protein 90, putative Inhibitor Cromoglicate Family 14 2827
DNA Binder Methoxsalen Family 10 1638
Vitamin K-dependent gamma-carboxylase Inhibitor Anisindione Fa... 3 243
D-alanyl-D-alanine carboxypeptidase Inhibitor B-lactams Family 59 1364
Aldehyde oxidase Inhibitor Isovanillin Family 6 429
Muscarinic acetylcholine receptor Ligand Mebeverine Family 2 27
Hidrosmin family 14 61
Ipriflavone family 62 2480
Rotenone family 16 107
taste receptor Ligand Cynarin Family 6 124
Agrimophol family 10 22
Chromomycin A3 family 7 14
Leukotriene B4 receptor 1 Ligand LY293111 Family 24 79
Sphingosine kinase 2 Inhibitor Phenoxodiol Family 24 682
NAD-dependent protein deacetylase sirtuin-1 Inhibitor SRT501 F... 19 88
Steryl-sulfatase Inhibitor Stx 64 Family 7 160
DNA topoisomerase 2-beta Inhibitor TOP-53 Family 2 12
cAMP-specific 3',5'-cyclic phosphodiesterase 4A and cAMP-speci... 9 123
Translocator protein Inhibitor Dextofisopam Family 3 250
Transient receptor potential cation channel subfamily V member... 29 18
Multidrug resistance protein Inhibitor Curcumin I Family 19 278
Oxi4503 family 4 27
Free fatty acid receptor 1 Ligand TAK-875 Family 2 54
Interleukin-1 beta Inhibitor Diacerein Family 3 77
Glucose-6-phosphate translocase Inhibitor Kodaistatin A Family 1 0
Integrase Inhibitor L-708,906 Family 1 8
Macrophage migration inhibitory factor and Prothrombin Inhibit... 2 49
Estrogen receptor beta Ligand 2-(4-hydroxy-phenyl)benzofuran-5... 5 82
Phospholipase A2 Inhibitor P-anisic Acid Family 2 178
Peroxisome proliferator-activated receptor gamma Ligand (2s)-2... 10 126
Arachidonate 15-lipoxygenase Inhibitor Isoscopoletin Family 5 98
Platelet-activating factor receptor Ligand L-652731 Family 5 116
Leukotriene B4 receptor 1 and Leukotriene B4 receptor 2 Ligand... 4 26
Steryl-sulfatase Inhibitor Sulfamic Acid 4-(3-methoxy-benzoyl)... 5 24
cAMP-specific 3',5'-cyclic phosphodiesterase 4A Inhibitor 2,5-... 2 96
Endothelin B receptor and Endothelin-1 receptor Ligand PD-1631... 9 13
Protein kinase C alpha type and Protein kinase C beta type Inh... 7 1
Epidermal growth factor receptor Ligand AG-538 Family 5 11
Oestrogen receptor and Estrogen receptor beta Ligand 7-chloro-... 2 27
Phospholipase A2 Inhibitor 3,9-dihydroxy-2,10-diprenylpterocap... 9 25
3-oxo-5-alpha-steroid 4-dehydrogenase 1 and 3-oxo-5-alpha-ster... 2 56
3-oxo-5-alpha-steroid 4-dehydrogenase 1 and 3-oxo-5-alpha-ster... 9 81
3-oxo-5-alpha-steroid 4-dehydrogenase 1 and 3-oxo-5-alpha-ster... 2 3
Amine oxidase [flavin-containing] A and Amine oxidase [flavin-... 4 127
Oestrogen receptor and Estrogen receptor beta Ligand 3,8-dihyd... 20 57
Carbonic anhydrase 1 and Carbonic anhydrase 2 Inhibitor Ellagi... 1 11
Tubulin beta chain Inhibitor Combretastatin Family 3 5
Fatty acid-binding protein, adipocyte and Fatty acid-binding p... 4 102
Tyrosine-protein phosphatase non-receptor type 1 Ligand Phelli... 1 1
L-selectin and P-selectin Inhibitor 2,3,4-trihydroxybenzoic Ac... 2 10
Arachidonate 15-lipoxygenase and Arachidonate 5-lipoxygenase I... 3 18
Tyrosine-protein phosphatase non-receptor type 1 Ligand Licoag... 9 32
Acetylcholinesterase Inhibitor AP-2238 Family 2 109
Sodium/glucose cotransporter 2 Inhibitor Maackiain Family 1 5
Carbonic anhydrase 9 and Carbonic anhydrase 12 Inhibitor Ethox... 12 80
Protein kinase C alpha type and Protein kinase C beta type Inh... 2 1
Protein kinase C alpha type Inhibitor Acetoside Family 5 39
MO15-related protein kinase Pfmrk Inhibitor WR-289012 Family 2 17
Cannabinoid receptor 1 and Cannabinoid receptor 2 Ligand 3-ben... 4 74
Cannabinoid receptor 2 Ligand 2-(2-methoxybenzyl)-3h-benzo[f]c... 6 32
Squalene monooxygenase Inhibitor Octyl_gallate Family 5 5
Cytochrome P450 3A4 Inhibitor (8r,8'r,9's)-5-methoxyclusin Family 6 20
Cytochrome P450 3A4 Inhibitor Hinokinin Family 2 10
Cytochrome P450 3A4 Inhibitor (-)-cubebininolide Family 4 28
NAD(P)H dehydrogenase [quinone] 1 Inhibitor Ethyl Bis(4-hydrox... 5 7
Aromatase Inhibitor 3,4-bis(3,4-dimethoxyphenyl)furan-2(5h)-on... 4 86
Amine oxidase [flavin-containing] B Inhibitor 4-oxo-4h-chromen... 2 3
NF-kappa-B Inhibitor Rocaglamide Family 8 8
Cytochrome P450 3A4 Inhibitor Diethoxyflourescein Family 3 9
Voltage-dependent N-type calcium channel subunit alpha-1B Liga... 1 6
Heat shock cognate 71 kDa protein Inhibitor NSC-119913 Family 2 1
Epidermal growth factor receptor Ligand 3-(3-chloro-phenyl)-5,... 10 64
Protein farnesyltransferase subunit beta Inhibitor Cylindrol A... 3 43
Prostaglandin G/H synthase 1 and Prostaglandin G/H synthase 2 ... 3 0
Acetylcholinesterase Inhibitor 4-formylphenyl-o-beta-d-ribopyr... 2 17
Prostaglandin G/H synthase 2 Inhibitor 3,4-dibenzyloxy-2'-hydr... 7 40
Androgen receptor Ligand Palodesangren E Family 12 43
CGMP-dependent protein kinase Inhibitor Tenellone A Family 1 7
Amine oxidase [flavin-containing] A and Amine oxidase [flavin-... 3 27
Prostaglandin G/H synthase 2 Inhibitor Neolignan 9-nor-7,8-deh... 1 7
Amine oxidase [flavin-containing] B Inhibitor Methyl Piperate ... 1 19
72 kDa type IV collagenase Inhibitor Lithospermic Acid Family 1 0
Liver carboxylesterase 1 Inhibitor 2-methoxy-3,4-methylenediox... 4 26
Leukotriene B4 receptor 1 and Leukotriene B4 receptor 2 ligand... 6 6
Peroxisome proliferator-activated receptor alpha and Peroxisom... 2 7
Acetylcholinesterase inhibitor AGN-PC-003A5N family 3 9
Endothelin-1 receptor ligand (2S)-2-(1,3-benzodioxol-5-yl)-4-m... 17 0
Cocaine esterase and Liver carboxylesterase 1 inhibitor 2-Chlo... 1 5
Arachidonate 5-lipoxygenase inhibitor 7-[[3-fluoro-5-[(1S,3S,5... 2 0
Endothelin-1 receptor ligand SureCN8117947 family 1 3
Peroxisome proliferator-activated receptor delta and Peroxisom... 4 2
Eukaryotic initiation factor 4A-I inhibitor methyl (1R,2R,3S,3... 12 1
Peroxisome proliferator-activated receptor delta ligand SureCN... 1 0
Protein kinase C alpha type inhibitor [2-(hydroxymethyl)-5-oxo... 2 4
Amine oxidase [flavin-containing] B and Amine oxidase [flavin-... 7 13
cAMP-specific 3',5'-cyclic phosphodiesterase 4A and cAMP-speci... 2 7
Androgen receptor and Estrogen receptor ligand estradiol benzo... 1 29
Endothelin-1 receptor and Endothelin B receptor ligand SureCN7... 2 2
Endothelin-1 receptor ligand SureCN7952886 family 1 0
Endothelin B receptor and Endothelin-1 receptor ligand AGN-PC-... 2 0
Endothelin-1 receptor ligand 2-(1,3-benzodioxol-5-yl)-4-(4-met... 1 1
Gamma-aminobutyric acid receptor subunit pi and GABA theta sub... 1 1
Platelet-activating factor receptor ligand (2S,3R,3aS)-2-(3,4-... 2 7
Free fatty acid receptor 1 ligand 2-[(8S)-3-(3-bromophenyl)-2,... 2 3
Free fatty acid receptor 1 ligand 2-[(3R,8S)-3-(3-chlorophenyl... 2 2
Free fatty acid receptor 1 ligand 2-[(8S)-3-[5-[2-chloro-4-(3-... 3 3
Endothelin-1 receptor and Endothelin B receptor ligand SureCN8... 3 1
Putative fructose-1,6-bisphosphate aldolase and Retinal dehydr... 1 0
cAMP-specific 3',5'-cyclic phosphodiesterase 4A and cAMP-speci... 2 4
Cytochrome P450 3A4 inhibitor 4-[(2E)-6-[(E)-3-hydroxy-2,6-dim... 3 2
Cholesteryl ester transfer protein inhibitor [8-[(1S)-1-hydrox... 4 10
Carbonic anhydrase 9 and Carbonic anhydrase 12 inhibitor 5,10-... 1 0
Prothrombin inhibitor sodium;[3-ethoxycarbonyl-2-[[3-ethoxycar... 1 6
Indoleamine 2,3-dioxygenase 1 inhibitor AGN-PC-04S2CP family 1 3
Arachidonate 5-lipoxygenase inhibitor AGN-PC-00PO2W family 1 1
Arachidonate 5-lipoxygenase inhibitor 5-(1,3-benzodioxol-5-yl)... 2 2
Tyrosine-protein kinase Lck and Tyrosine-protein kinase Fyn in... 1 2
Cholesteryl ester transfer protein inhibitor [8-[(1S)-1-hydrox... 1 0
Sugar Acids and Derivatives Metabolite 3-Methoxy-4-hydroxyphen... 1 6
Benzopyrans Metabolite Erosnin Family 1 0
Phenylacetic Acid Derivatives Metabolite Guaicyl phenylacetate... 1 3
Prenol Lipids Metabolite Rosmadial Family 1 0
Acenes Metabolite Musanolone D Family 2 1
Putative NP ZINC31158464 Family 3 5
Putative NP ZINC02398203 Family 1 0
NP (z)-2-(2,3-dimethoxybenzylidene)-3-oxo-2,3-dihydrobenzofura... 9 0
2-benzoyl-3-(3,4-dimethoxyphenyl)-2-ethylcyclopropane-1,1-dica... 4 0
1,3-dimethylcyclohepta[c]furan-8-one NP 6-(4-hydroxy-3-iodo-5-... 13 1
2H,2'H-[3,4'-bichromene]-2,2'-dione NP 7'-((3-bromobenzyl)oxy)... 3 0
NP 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6-ethyl-4-oxo-4h-ch... 33 4
NP 2-((3-(3,4-dihydro-2h-benzo[b][1,4]dioxepin-7-yl)-6-ethyl-4... 10 0
Putative NP ZINC04025923 Family 6 0
NP (z)-6-((4-bromobenzyl)oxy)-2-(3,4-dimethoxybenzylidene)benz... 13 2
NP 2-((3-(3,4-dihydro-2h-benzo[b][1,4]dioxepin-7-yl)-2-methyl-... 2 0
NP 4-(2,3,4-trimethoxyphenyl)-3,4-dihydro-2h-benzo[g]chromene-... 2 1
benzenesulfonate NP (z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-... 26 0
2-[(3,4-dimethoxyphenyl)methyl]propanedioate NP 4aji Family 1 0
NP 4-(3,4-dimethoxyphenyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)but... 2 3
bromobenzoate NP ZINC09346025 Family 20 0
Putative NP ZINC09051797 Family 10 0
Putative NP ZINC09306352 Family 7 0
Putative NP ZINC09575270 Family 7 0
Putative NP ZINC08382321 Family 8 2


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00191693 CHEMBL10854 Bioactive SureCN8022425
CFAMM00191804 CHEMBL604286 Bioactive AGN-PC-07BWOK
CFAMM00191907 CHEMBL268480 Bioactive SureCN8033478
CFAMM00191794 CHEMBL10781 Bioactive SureCN8032076
CFAMM00191812 CHEMBL11369 Bioactive SureCN8031177
CFAMM00191698 CHEMBL274359 Bioactive SureCN8034209
CFAMM00191736 CHEMBL10635 Bioactive 3-(1,3-benzodioxol-5-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-5-hydroxy-5-(4-methoxyphenyl)furan-2-one
CFAMM00192053 CHEMBL10607 Bioactive 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(3-methoxyphenyl)methyl]furan-2-one
CFAMM00191959 CHEMBL174573 Bioactive (Z)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(3,4,5-trimethoxyphenyl)methyl]but-2-enoic acid
CFAMM00191882 CHEMBL275701 Bioactive SureCN8035297
CFAMM00192064 CHEMBL10843 Bioactive SureCN8031556
CFAMM00191735 CHEMBL10636 Bioactive SureCN8035487
CFAMM00191851 CHEMBL177378 Bioactive (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-[(3,4,5-triethoxyphenyl)methyl]but-2-enoic acid
CFAMM00191771 CHEMBL291058 Bioactive methyl 5-[5-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]-2,3-dimethoxyphenoxy]pentanoate
CFAMM00191788 CHEMBL417067 Bioactive 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(3,4,5-triethoxyphenyl)methyl]furan-2-one
CFAMM00191900 CHEMBL304762 Bioactive 4-[5-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]-2,3-dimethoxyphenoxy]butanoic acid
CFAMM00191827 CHEMBL69832 Bioactive 5-[5-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]-2,3-dimethoxyphenoxy]pentanoic acid
CFAMM00191965 CHEMBL369085 Bioactive (Z)-3-benzyl-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
CFAMM00191868 CHEMBL11176 Bioactive methyl 3-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]benzoate
CFAMM00191858 CHEMBL177973 Bioactive (Z)-2-(1,3-benzodioxol-5-yl)-3-[[3,4-dimethoxy-5-(5-methoxy-5-oxopentoxy)phenyl]methyl]-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
CFAMM00191921 CHEMBL11115 Bioactive SureCN8033782
CFAMM00191995 CHEMBL594482 Bioactive AGN-PC-07BWOJ
CFAMM00191770 CHEMBL10794 Bioactive SureCN8031759
CFAMM00191825 CHEMBL408055 Bioactive AGN-PC-047BIZ
CFAMM00191942 CHEMBL69986 Bioactive methyl 4-[5-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]-2,3-dimethoxyphenoxy]butanoate
CFAMM00191702 CHEMBL10924 Bioactive SureCN8031857
CFAMM00191912 CHEMBL70017 Bioactive SureCN8031720
CFAMM00191929 CHEMBL594265 Bioactive AGN-PC-07R80U
CFAMM00191973 CHEMBL308646 Bioactive methyl 2-[5-[[4-(1,3-benzodioxol-5-yl)-2-hydroxy-2-(4-methoxyphenyl)-5-oxofuran-3-yl]methyl]-2,3-dimethoxyphenoxy]acetate
CFAMM00191897 CHEMBL10744 Bioactive 3-(1,3-benzodioxol-5-yl)-5-hydroxy-4-[(4-hydroxyphenyl)methyl]-5-(4-methoxyphenyl)furan-2-one
CFAMM00191941 CHEMBL1672880 Bioactive AGN-PC-08Y2SY
CFAMM00191963 CHEMBL273723 Bioactive SureCN8035313
CFAMM00191866 CHEMBL175129 Bioactive (Z)-2-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-3-[(4-methoxyphenyl)methyl]-4-oxobut-2-enoic acid
CFAMM00191885 CHEMBL177886 Bioactive (Z)-3-(cyclohexylmethyl)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-oxobut-2-enoic acid
CFAMM00191776 CHEMBL416675 Bioactive SureCN7943804
CFAMM00191969 CHEMBL275559 Bioactive SureCN8031885
CFAMM00192007 DNC004317 Investigative Drug PD-155080
CFAMM00191784 DNC001099 Investigative Drug PD156707

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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