CFam Chemical Families Database
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You are searching for "CFAMM00235454" 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 CFAMM00235454
Family CFFID1315 Epidermal growth factor receptor Ligand PD-158780 Family
Superfamily CFSID630 Epidermal growth factor receptor and Metabotropic glutamate receptor 5 Binder Superfamily
Class CFCAD202 Class 202
External ID CHEMBL162981 External Source CHEMBL
PubChem CID 5328368 Functional Category Bioactive
Molecule Name PD158780 Analog 5v
IUPAC Name 4-N-(3-bromophenyl)-6-N-(3-imidazol-1-ylpropyl)pyrido[3,4-d]pyrimidine-4,6-diamine
Synonyms AC1NS4E0;4-N-(3-bromophenyl)-6-N-(3-imidazol-1-ylpropyl)pyrido[3,4-d]pyrimidine-4,6-diamine
InChi InChI=1S/C19H18BrN7/c20-14-3-1-4-15(9-14)26-19-16-10-18(23-11-17(16)24-12-25-19)22-5-2-7-27-8-6-21-13-27/h1,3-4,6,8-13H,2,5,7H2,(H,22,23)(H,24,25,26)
InChiKey IUQWETRSDSASNL-UHFFFAOYSA-N
Formula C19H18BrN7 Molecular Weight 424.30
Cross Link CHEMBL162981
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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