Molecule Details
InChIKeyRAYLNBXWZYCOPI-IZOJJSPNSA-N
Compound Name(8S,9S,13S,14S,17S)-2-chloro-17-[di(propan-2-yl)carbamoyl]-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3-carboxylic acid
Canonical SMILESCC(C)N(C(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(C(=O)O)c(Cl)cc4[C@H]3CC[C@]12C)C(C)C
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)2
Pfam Stratification Cross-Family
Avg pChEMBL7.46
SourceChEMBL;BindingDB;TTD_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 7.5 pIC50 TTD_MultiTarget
P31639 SLC5A2 Homo sapiens Human PF00474 7.5 pIC50 TTD_MultiTarget