Molecule Details
InChIKeySBOSVLRBKPEZMQ-QGZVFWFLSA-N
Compound Name(3~{R})-6-[(4-isoquinolin-4-ylpyrimidin-2-yl)amino]-1,3-dimethyl-4-propan-2-yl-3~{H}-quinoxalin-2-one
Canonical SMILESCC(C)N1c2cc(Nc3nccc(-c4cncc5ccccc45)n3)ccc2N(C)C(=O)[C@H]1C
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.44
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O60885 BRD4 Homo sapiens Human PF17035 PF17105 PF00439 7.9 IC50 ChEMBL;BindingDB
P50750 CDK9 Homo sapiens Human PF00069 7.7 IC50 ChEMBL;BindingDB
P24941 CDK2 Homo sapiens Human PF00069 6.8 IC50 ChEMBL;BindingDB