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

Family Name Cathepsin S inhibitor methyl 2-amino-4-[[(2S)-3-cyclohexyl-1-[[4-[(2-ethoxy-2-oxoethyl)amino]-3,4-dioxo-1-phenylmethoxybutan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]benzoate family
No. of Seeds 2 No. of Other Members 3
Family Centroid CFAMM00314207 Functional Category Bioactive
Superfamily Cathepsin S Binder Superfamily
Class Class 2317

Cousin Family NamesSeedsMembers
Intedanib family 7 54
Cathepsin S inhibitor ethyl 2-[[3-[[(2S)-3-cyclohexyl-2-[(3-me... 3 2
Cathepsin S inhibitor ethyl 2-[[3-[[(2S)-2-[(3-amino-4-chlorob... 1 0
Substance-P receptor ligand (2S)-2-N-[(2S)-1-[benzyl(methyl)am... 3 3
Caspase-9 and Caspase-8 inhibitor 4-fluoro-2-[[2-[[(2S)-3-meth... 1 11
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 1 0
Gastrin/cholecystokinin type B receptor and Cholecystokinin re... 2 1


External ID

Functional Category

Molecule Name

CFAMM00314207 CHEMBL1085969 Bioactive methyl 2-amino-4-[[(2S)-3-cyclohexyl-1-[[4-[(2-ethoxy-2-oxoethyl)amino]-3,4-dioxo-1-phenylmethoxybutan-2-yl]amino]-1-oxopropan-2-yl]carbamoyl]benzoate
CFAMM00314206 CHEMBL1085979 Bioactive ethyl 2-[[(3S)-3-[[(2S)-2-[(2-amino-5-bromobenzoyl)amino]-3-cyclohexylpropanoyl]amino]-2-oxo-4-phenylmethoxybutanoyl]amino]acetate

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).

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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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Computer-aided Drug Design
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