Molecule Details
InChIKeyAQVOTCCORNBNKJ-NXKJGXAASA-N
Compound Name(10R,13S,17S)-10,13-dimethyl-3-nitro-N,N-di(propan-2-yl)-2,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-17-carboxamide
Canonical SMILESCC(C)N(C(=O)[C@H]1CCC2C3CCC4C=C([N+](=O)[O-])CC[C@]4(C)C3CC[C@@]21C)C(C)C
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL7.3
SourceTTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P18505 GABRB1 Homo sapiens Human PF02931 PF02932 7.3 pIC50 TTD_MultiTarget
P31639 SLC5A2 Homo sapiens Human PF00474 7.3 pIC50 TTD_MultiTarget