CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00473454" in compound.

Total 1 results found.

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

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CFAM Mol ID CFAMM00473454
Family CFFBM25216 Poly [ADP-ribose] polymerase 1 inhibitor CHEMBL1935256 family
Superfamily CFSID1458 Poly [ADP-ribose] polymerase 1 and Serine/threonine-protein kinase Chk1 Binder Superfamily 2
Class CFCCD116 Class 929
External ID CHEMBL1935256 External Source CHEMBL
PubChem CID 57392280 Functional Category Bioactive
Molecule Name CHEMBL1935256
IUPAC Name
Synonyms AGN-PC-0BTHXK
InChi InChI=1S/C21H15N5O3/c27-15(7-26-9-22-8-23-26)10-4-5-14-13(6-10)16-18-17(20(28)25-21(18)29)11-2-1-3-12(11)19(16)24-14/h4-6,8-9,24H,1-3,7H2,(H,25,28,29)
InChiKey IGOCWSKTDTXNEB-UHFFFAOYSA-N
Formula C21H15N5O3 Molecular Weight 385.38
Cross Link CHEMBL1935256
Structure

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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