CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00279125" 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.

Search Results

CFAM Mol ID CFAMM00279125
Family CFFID2888 Glycogen synthase kinase-3 beta Inhibitor 4-(5-bromo-1h-indol-3-yl)pyrimidin-2-amine Family
Superfamily CFSAD209 Toll-like receptor 7 Ligand Imiquimod Superfamily
Class CFCAD202 Class 202
External ID CHEMBL183535 External Source CHEMBL
PubChem CID 44393130 Functional Category Bioactive
Molecule Name AGN-PC-075EQL
IUPAC Name 4-[5-[2-[3-(3-bromophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]ethynyl]pyridin-2-yl]morpholine
Synonyms CHEBI:406898;4-[5-[2-[3-(3-bromophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-yl]ethynyl]pyridin-2-yl]morpholine
InChi InChI=1S/C22H17BrN6O/c23-17-3-1-2-16(12-17)21-20-18(25-14-26-22(20)28-27-21)6-4-15-5-7-19(24-13-15)29-8-10-30-11-9-29/h1-3,5,7,12-14H,8-11H2,(H,25,26,27,28)
InChiKey DHZRBLWTWFPJJQ-UHFFFAOYSA-N
Formula C22H17BrN6O Molecular Weight 461.31
Cross Link CHEMBL183535
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
 

 

54857 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

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00279125'),None, txtsearch, CFAMM00279125|