CFam Chemical Families Database
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You are searching for "CFAMM00420905" in compound.

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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.

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CFAM Mol ID CFAMM00420905
Family CFFBM13174 Glycogen synthase kinase-3 beta and Cyclin-dependent kinase 2 inhibitor AGN-PC-077NPP family
Superfamily CFSBM2362 Glycogen synthase kinase-3 beta and Cyclin-dependent kinase 2 Binder Superfamily
Class CFCID1148 Class 2498
External ID CHEMBL489833 External Source CHEMBL
PubChem CID 44582745 Functional Category Bioactive
Molecule Name SureCN3148145
IUPAC Name 3-(5-bromo-1-methylindol-3-yl)-4-[6-(hydroxymethyl)-1-benzofuran-3-yl]pyrrole-2,5-dione
Synonyms AGN-PC-077NS5;CHEBI:599108;3-(5-bromo-1-methylindol-3-yl)-4-[6-(hydroxymethyl)-1-benzofuran-3-yl]pyrrole-2,5-dione
InChi InChI=1S/C22H15BrN2O4/c1-25-8-15(14-7-12(23)3-5-17(14)25)19-20(22(28)24-21(19)27)16-10-29-18-6-11(9-26)2-4-13(16)18/h2-8,10,26H,9H2,1H3,(H,24,27,28)
InChiKey GAVPKFXPGFHFSY-UHFFFAOYSA-N
Formula C22H15BrN2O4 Molecular Weight 451.27
Cross Link CHEMBL489833
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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