Molecule Details
InChIKeyRHYVGCKRBKDRDX-RQJMMSBLSA-L
Canonical SMILESCC1=C2N=C(C=C3[N-]C(=C(C)C4=N[C@@](C)([C@@H]5N=C1[C@](C)(CCC(=O)NC[C@@H](C)OP(=O)([O-])O[C@H]1[C@@H](O)[C@@H](n6cnc7cc(C)c(C)cc76)O[C@@H]1CO)[C@H]5CC(N)=O)[C@@](C)(CC(N)=O)[C@@H]4CCC(N)=O)[C@@](C)(CC(N)=O)[C@@H]3CCC(N)=O)C(C)(C)[C@@H]2CCC(N)=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL6.36
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P55211 CASP9 Homo sapiens Human PF00619 PF00656 6.4 IC50 BindingDB
O14727 APAF1 Homo sapiens Human PF17908 PF00619 PF00931 PF00400 PF21296 6.3 IC50 BindingDB