Molecule Details
InChIKeyNYMXQEKCEGCXNT-JOCHJYFZSA-N
Compound NameN-{5-[(2R)-2-fluoro-2-phenylacetyl]-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-3-yl}-4-(4-methylpiperazin-1-yl)benzamide
Canonical SMILESCN1CCN(c2ccc(C(=O)Nc3n[nH]c4c3CN(C(=O)[C@H](F)c3ccccc3)C4)cc2)CC1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.54
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O14965 AURKA Homo sapiens Human PF00069 8.1 IC50 ChEMBL;BindingDB
O75716 STK16 Homo sapiens Human PF00069 8.1 pIC50 TTD_MultiTarget
Q96GD4 AURKB Homo sapiens Human PF00069 6.5 IC50 ChEMBL;BindingDB