CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00311091" 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 CFAMM00311091
Family CFFBM399 Protein kinase C theta type and Protein kinase C delta type inhibitor SureCN2935541 family
Superfamily CFSBM253 Protein kinase C theta type and Protein kinase C delta type Binder Superfamily
Class CFCID316 Class 1666
External ID CHEMBL1095369 External Source CHEMBL
PubChem CID 46881640 Functional Category Bioactive
Molecule Name 5-[(E)-2-[3-[(4-hydroxypiperidin-1-yl)methyl]phenyl]ethenyl]-4-[(4-methyl-1H-indol-5-yl)amino]pyridine-3-carbonitrile
IUPAC Name 5-[(E)-2-[3-[(4-hydroxypiperidin-1-yl)methyl]phenyl]ethenyl]-4-[(4-methyl-1H-indol-5-yl)amino]pyridine-3-carbonitrile
Synonyms CHEBI:715832
InChi InChI=1S/C29H29N5O/c1-20-26-9-12-32-28(26)8-7-27(20)33-29-23(17-31-18-24(29)16-30)6-5-21-3-2-4-22(15-21)19-34-13-10-25(35)11-14-34/h2-9,12,15,17-18,25,32,35H,10-11,13-14,19H2,1H3,(H,31,33)/b6-5+
InChiKey UJBAYCIQPBHHBB-AATRIKPKSA-N
Formula C29H29N5O Molecular Weight 463.57
Cross Link CHEMBL1095369
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
 

 

26858 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', 'CFAMM00311091'),None, txtsearch, CFAMM00311091|