Molecule Details
InChIKeySOXXWGSPFAGLBY-UHFFFAOYSA-N
Compound NameN-[5-[(1-cycloheptylpyrazolo[3,4-d]pyrimidin-6-yl)amino]-2-pyridinyl]-N-[2-(dimethylamino)ethyl]methanesulfonamide
Canonical SMILESCN(C)CCN(c1ccc(Nc2ncc3cnn(C4CCCCCC4)c3n2)cn1)S(C)(=O)=O
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.53
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P06493 CDK1 Homo sapiens Human PF00069 8.0 pIC50 TTD_MultiTarget
P14635 CCNB1 Homo sapiens Human PF02984 PF00134 8.0 IC50 ChEMBL
O14965 AURKA Homo sapiens Human PF00069 6.6 IC50 ChEMBL;BindingDB