CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
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 CFFID2248
Family Name Beta-secretase 1 and Cathepsin D Inhibitor GRL-7234 Family
No. of Seeds 17 No. of Other Members 148
Family Centroid CFAMM00263139 Functional Category Investigative Drug
Superfamily Beta-secretase 1 and Cathepsin D Inhibitor GRL-7234 Superfamily
Class Class 2399

Cousin Family NamesSeedsMembers
5-alpha reductase inhibitor azasteroid derivative Dutasteride ... 36 124
Alpha adrenergic receptor Ligand Droperidol Family 20 244
Sodium channel protein type 5 subunit alpha Ligand Procainamid... 7 291
Motilin receptor Ligand GSK962040 Family 30 457
Kappa-type opioid receptor Ligand Asimadoline Family 14 54
Histone deacetylase 1 Inhibitor AN-9 Family 31 282
Pan-DAC Inhibitor AR-42 Family 21 153
Amonafide family 3 35
Intedanib family 7 54
Dual specificity mitogen-activated protein kinase kinase Inhib... 7 69
Potassium voltage-gated channel subfamily A member 5 Ligand S-... 34 206
Vasopressin V2 receptor Ligand FR161282 Family 17 83
Vasopressin V1a receptor and Vasopressin V2 receptor Ligand OP... 12 94
Urokinase-type plasminogen activator Inhibitor 6-(n-phenylcarb... 2 11
Beta-secretase 1 Inhibitor MMI-175 Family 30 137
Potassium voltage-gated channel subfamily A member 5 Ligand N-... 8 32
Plasmepsin-2 Inhibitor PS-222036 Family 12 134
Plasmepsin-1 Inhibitor SC-5003 Family 93 173
Integrin beta-3 Inhibitor L-750034 Family 7 38
Integrin beta-3 Inhibitor SB-208651 Family 9 28
Cathepsin K and Cathepsin L1 Inhibitor N-benzoyl-phenylalanyl-... 13 77
Cholecystokinin receptor type A Ligand VL-1499 Family 12 133
Aurora kinase B Inhibitor Hesperadin Family 1 1
Voltage-dependent T-type calcium channel subunit alpha-1H Liga... 3 26
Beta-secretase 1 Inhibitor KMI-538 Family 4 20
Delta-type opioid receptor and Kappa-type opioid receptor Liga... 6 24
Delta-type opioid receptor and Mu-type opioid receptor Ligand ... 14 110
Beta-secretase 1 Inhibitor GSK-188909 Family 16 11
Cannabinoid receptor 2 Ligand N1-(4-bromophenyl)-n2,n2-dipenty... 4 21
5-hydroxytryptamine receptor 7 Ligand UCM-5600 Family 15 46
Amine oxidase [flavin-containing] A and Amine oxidase [flavin-... 4 12
Vasopressin V2 receptor Ligand VA-106483 Family 16 115
Baculoviral IAP repeat-containing protein 3 and E3 ubiquitin-p... 44 28
Gamma-aminobutyric acid receptor subunit alpha-1 and Gamma-ami... 15 129
5-hydroxytryptamine receptor 2A Ligand N-(1-(4-nitrobenzyl)pip... 4 6
Cholecystokinin receptor type A Ligand CR-1795 Family 19 41
Vasopressin V1a receptor ligand AGN-PC-074VJP family 3 1
Beta-secretase 1 and Cathepsin D inhibitor 3ixk family 2 9
Beta-secretase 1 and Cathepsin D inhibitor 3ixj family 10 21
Acetylcholinesterase inhibitor AGN-PC-07ZFTY family 1 0
72 kDa type IV collagenase and Stromelysin-1 inhibitor [(2S)-2... 9 6
Beta-secretase 1 and Cathepsin D inhibitor 3-(4-chloro-N-methy... 1 0
Beta-secretase 1 and Beta-secretase 2 inhibitor SureCN5224847 ... 3 24
C-C chemokine receptor type 3 ligand 4-[(3-acetylphenyl)carbam... 3 4
Lethal factor inhibitor (2R)-2-(4-fluoro-3,5-dimethylanilino)-... 11 8
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[[(2S)-1... 6 6
Pol polyprotein inhibitor 183860-48-2 family 5 1
Apolipoprotein B-100 and Microsomal triglyceride transfer prot... 10 0
Apolipoprotein B-100 and Microsomal triglyceride transfer prot... 6 5
72 kDa type IV collagenase and Stromelysin-1 inhibitor (2R)-N-... 2 7
D(3) dopamine receptor and Alpha-1B adrenergic receptor ligand... 11 8
Cellular tumor antigen p53 inhibitor CHEMBL1554992 family 1 0
Integrin beta-1 and Integrin alpha-4 inhibitor (2S)-2-[(1-benz... 5 2
Stromelysin-1 and 72 kDa type IV collagenase inhibitor (2R)-2-... 2 1
Histone deacetylase and Histone deacetylase 3 inhibitor (3S,6S... 2 4
Melanin-concentrating hormone receptor 1 ligand AGN-PC-075BLN ... 2 1
Pol polyprotein inhibitor 3-[(4R,5R,6R)-4-benzyl-3-(3-carbamoy... 3 1
Follicle-stimulating hormone receptor ligand AGN-PC-005HER family 5 2
C-C chemokine receptor type 3 and Sodium-dependent serotonin t... 12 2
Delta-type opioid receptor and Potassium voltage-gated channel... 3 2
C-C chemokine receptor type 2 ligand N-[2-[[(2S,3S)-1-[(2,4-di... 13 8
C-C chemokine receptor type 2 ligand N-[3-amino-5-(trifluorome... 4 1
Muscarinic acetylcholine receptor M2 and Muscarinic acetylchol... 5 19
Microsomal triglyceride transfer protein large subunit inhibit... 8 1
Cathepsin D and Cathepsin E inhibitor methyl (2S)-1-[(2R)-2-[[... 1 0
C-C chemokine receptor type 3 ligand 1-(3-acetylphenyl)-3-[3-[... 9 1
P2X purinoceptor 7 inhibitor 2-[3-fluoro-4-(trifluoromethyl)ph... 3 0
Vesicular acetylcholine transporter and Sigma non-opioid intra... 5 0
C-C chemokine receptor type 2 ligand 2-amino-N-[2-[[(3R)-1-[(4... 5 1
Beta-secretase 1 inhibitor CHEMBL400438 family 5 16
Beta-secretase 1 inhibitor 1-N-[(1R,2S)-1-[(2R,4S)-4-butoxypip... 5 1
Beta-secretase 1 and Beta-secretase 2 inhibitor 3-(1,1-dioxoth... 6 2
Pol polyprotein inhibitor 2,5-bis[(2-{[(benzyloxy)carbonyl]ami... 2 3
Proteinase-activated receptor 1 ligand 2-[[2-[[2-[acetyl-[(E)-... 6 15
Growth hormone secretagogue receptor type 1 ligand 2-amino-2-m... 4 2
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 7 12
Cholecystokinin receptor type A and Gastrin/cholecystokinin ty... 11 4
Beta-secretase 1 inhibitor N-[(2S,3R)-1-(3,5-difluorophenyl)-3... 5 5
Beta-3 adrenergic receptor and Beta-1 adrenergic receptor liga... 2 0
Pol polyprotein inhibitor 3-amino-N-[(2S,3S,4R,5S)-5-[(3-amino... 2 1
Histone deacetylase 6 and Histone deacetylase 2 inhibitor 4-[[... 2 1
P2X purinoceptor 7 inhibitor 2-(1-adamantyl)-N-[2-(1-hydroxy-3... 3 0
Delta-type opioid receptor and Mu-type opioid receptor ligand ... 3 3
Cathepsin E and Cathepsin D inhibitor SureCN2529506 family 2 0
Pol polyprotein inhibitor AC1LA3BI family 4 1
Protein farnesyltransferase subunit beta and Protein farnesylt... 4 13


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00263181 CHEMBL378225 Bioactive beta-Secretase Inhibitor IV
CFAMM00263112 CHEMBL2047038 Bioactive N-[(12S)-12-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-2,14-dioxo-10-oxa-3,13-diazabicyclo[13.3.1]nonadeca-1(19),15,17-trien-17-yl]-N-methylmethanesulfonamide
CFAMM00263105 CHEMBL2047034 Bioactive N-[(6E,11S)-11-[(1R)-2-[(3-tert-butylphenyl)methylamino]-1-hydroxyethyl]-2,13-dioxo-9-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),6,14,16-tetraen-16-yl]-N-methylmethanesulfonamide
CFAMM00263166 CHEMBL1076901 Bioactive 3-N-[(2S,3S,5R)-6-[[(2S)-1-(benzylamino)-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-5-methyl-6-oxo-1-phenylmethoxyhexan-2-yl]-5-[methyl(methylsulfonyl)amino]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
CFAMM00263036 CHEMBL2179130 Bioactive 5-[methyl(methylsulfonyl)amino]-3-N-[(2S)-1-[[(2S)-1-(2-methylpropylamino)-1-oxobutan-2-yl]amino]-3-phenylpropan-2-yl]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
CFAMM00263110 CHEMBL2047033 Bioactive N-[(6E,11S)-11-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-2,13-dioxo-9-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),6,14,16-tetraen-16-yl]-N-methylmethanesulfonamide
CFAMM00263138 CHEMBL2047041 Bioactive N-[(4R,6E,11S)-11-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-2,13-dioxo-4-phenyl-9-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),6,14,16-tetraen-16-yl]-N-methylmethanesulfonamide
CFAMM00263178 CHEMBL1210344 Bioactive 3-(3-cyano-N-methylsulfonylanilino)-N-[(2S,3R)-4-[[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]benzamide
CFAMM00263035 CHEMBL2179131 Bioactive 3-N-[(2S)-1-[[(2S,3S)-3-hydroxy-1-(2-methylpropylamino)-1-oxobutan-2-yl]amino]-3-phenylpropan-2-yl]-5-[methyl(methylsulfonyl)amino]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
CFAMM00263123 CHEMBL385374 Bioactive SureCN8296649
CFAMM00263190 CHEMBL376277 Bioactive 3-N-[(2S,3R)-4-(cyclopropylamino)-3-hydroxy-1-phenylbutan-2-yl]-5-[dimethylsulfamoyl(methyl)amino]-1-N-[(1R)-1-phenylethyl]benzene-1,3-dicarboxamide
CFAMM00263143 CHEMBL379513 Bioactive SureCN14357016
CFAMM00263073 CHEMBL211563 Bioactive SureCN14357043
CFAMM00263148 CHEMBL209372 Bioactive SureCN14357036
CFAMM00263100 CHEMBL1644461 Bioactive SureCN8165121
CFAMM00263113 CHEMBL2047039 Bioactive N-[(4S,8Z)-4-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-12-methyl-2,13-dioxo-6-oxa-3,12-diazabicyclo[12.3.1]octadeca-1(18),8,14,16-tetraen-16-yl]-N-methylmethanesulfonamide
CFAMM00263139 DNC007372 Investigative Drug GRL-7234

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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