CFam Chemical Families Database
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You are searching for "CFAMM00284071" in compound.

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CFAM Mol ID CFAMM00284071
Family CFFID3106 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform Inhibitor PKI-402 Family
Superfamily CFSCD594 Serine/threonine-protein kinase mTOR and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform Binder Superfamily
Class CFCCD420 Class 1233
External ID CHEMBL576090 External Source CHEMBL
PubChem CID 45488060 Functional Category Bioactive
Molecule Name SureCN54886
IUPAC Name 4-[[4-[1-ethyl-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]carbamoylamino]-N-pyrrolidin-1-ylbenzamide
Synonyms AGN-PC-07CRQS;CHEBI:683278;4-[[4-[1-ethyl-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]carbamoylamino]-N-pyrrolidin-1-ylbenzamide
InChi InChI=1S/C31H35N9O3/c1-2-40-29-26(17-32-40)28(38-18-24-13-14-25(19-38)43-24)35-27(36-29)20-5-9-22(10-6-20)33-31(42)34-23-11-7-21(8-12-23)30(41)37-39-15-3-4-16-39/h5-12,17,24-25H,2-4,13-16,18-19H2,1H3,(H,37,41)(H2,33,34,42)
InChiKey QWUNRYMMAGVRMS-UHFFFAOYSA-N
Formula C31H35N9O3 Molecular Weight 581.67
Cross Link CHEMBL576090
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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