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 CFFBM17297
Family Name Integrin alpha-4 inhibitor (5R)-5-[[(2R)-2-[[2-[4-(1,3-benzoxazol-2-ylamino)phenyl]acetyl]amino]-6-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]hexanoyl]amino]-6-[(1-carbamoylcyclohexyl)amino]-6-oxohexanoic acid family
No. of Seeds 2 No. of Other Members 0
Family Centroid CFAMM00441694 Functional Category Bioactive
Superfamily Integrin alpha-4 and Cathepsin S Binder Superfamily
Class Class 678

Cousin Family NamesSeedsMembers
Vascular endothelial growth factor receptor 1 and Vascular end... 4 44
Neutrophil elastase Inhibitor Cbz-val-pro-val-(2-benzoxazole) ... 32 64
Integrin beta-3 and Integrin alpha-V inhibitor (3S)-3-(2-oxo-3... 2 11
Vascular endothelial growth factor receptor 2 and Mast/stem ce... 8 8
Tubulin beta-4A chain and Tubulin beta-2B chain inhibitor N-(2... 1 4
Vascular endothelial growth factor receptor 2 ligand 2-aminobe... 5 0
Integrin beta-1 and Integrin alpha-4 inhibitor 4-[[(2S,5S)-5-(... 20 10
Cathepsin S and Cathepsin L1 inhibitor (2S)-2-(1,3-benzoxazol-... 1 9
Integrin beta-1 and Integrin alpha-4 inhibitor 4-[[(2S,4S)-1-[... 2 0
Cytochrome P450 3A4 inhibitor 1,3-thiazol-5-ylmethyl N-[(2S,3R... 30 11


CFAM Mol ID

External ID

Functional Category

Molecule Name

CFAMM00441693 CHEMBL505729 Bioactive SureCN13058947
CFAMM00441694 CHEMBL454993 Bioactive (5R)-5-[[(2R)-2-[[2-[4-(1,3-benzoxazol-2-ylamino)phenyl]acetyl]amino]-6-[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]hexanoyl]amino]-6-[(1-carbamoylcyclohexyl)amino]-6-oxohexanoic acid

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
 

 

45058 visits since 2014 .........

 



Dr. Chen Yuzong

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


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543