CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00440761" 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 CFAMM00440761
Family CFFBM17145 RAC-alpha serine/threonine-protein kinase and RAC-beta serine/threonine-protein kinase inhibitor SureCN1501766 family
Superfamily CFSID1829 Potassium voltage-gated channel subfamily H member 2 and Vascular endothelial growth factor receptor 2 Ligand BMS-645737 Superfamily
Class CFCID1133 Class 2483
External ID CHEMBL446966 External Source CHEMBL
PubChem CID 11672017 Functional Category Bioactive
Molecule Name SureCN1501656
IUPAC Name 2-[4-[[4-[3-(6-methoxypyridin-3-yl)-1H-1,2,4-triazol-5-yl]piperidin-1-yl]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
Synonyms CHEBI:548075
InChi InChI=1S/C34H31N7O2/c1-43-30-12-11-26(20-36-30)33-38-32(39-40-33)25-14-17-41(18-15-25)21-22-7-9-24(10-8-22)31-27(23-5-3-2-4-6-23)19-28-29(37-31)13-16-35-34(28)42/h2-13,16,19-20,25H,14-15,17-18,21H2,1H3,(H,35,42)(H,38,39,40)
InChiKey JLQPVVYLBVGTJX-UHFFFAOYSA-N
Formula C34H31N7O2 Molecular Weight 569.66
Cross Link CHEMBL446966
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
 

 

27722 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', 'CFAMM00440761'),None, txtsearch, CFAMM00440761|