Molecule Details
InChIKeyYNWNNHNPVXWHLN-RCFJZYRUSA-N
Compound Name17-Diisopropylcarbamoyl-10,13-dimethyl-8,9,10,11,12,13,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid
Canonical SMILESCC(C)N(C(=O)[C@H]1CCC2C3C=CC4=CC(C(=O)O)=CC[C@]4(C)C3CC[C@@]21C)C(C)C
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL8.0
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P31213 SRD5A2 Homo sapiens Human PF02544 8.2 Ki ChEMBL;BindingDB
P18505 GABRB1 Homo sapiens Human PF02931 PF02932 7.9 pIC50 TTD_MultiTarget
P31639 SLC5A2 Homo sapiens Human PF00474 7.9 pIC50 TTD_MultiTarget