Molecule Details
InChIKeyVAPSMQAHNAZRKC-PQWRYPMOSA-N
Compound NameEpristeride
Canonical SMILESCC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C=C(C(=O)O)CC[C@]4(C)[C@H]3CC[C@]12C
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL7.8
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB19810
Drug NameEpristeride
CAS Number119169-78-7
Groups experimental
ATC Codes nan
DescriptionEpristeride is a small molecule drug. The usage of the INN stem '-steride' in the name indicates that Epristeride is a androgen/anabolic steroid. Epristeride has a monoisotopic molecular weight of 399.28 Da.

Categories: 5-alpha Reductase Inhibitors Androstanes Androstenes Enzyme Inhibitors Fused-Ring Compounds Hormone Antagonists Hormones, Hormone Substitutes, and Hormone Antagonists Steroid Synthesis Inhibitors Steroids
Cross-references: BindingDB: 50043604 ChEBI: 31552 CHEMBL138225 ZINC: ZINC000003796232
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
P31213 SRD5A2 Homo sapiens Human PF02544 9.2 IC50 ChEMBL;BindingDB
P18405 SRD5A1 Homo sapiens Human PF02544 6.4 Ki ChEMBL;BindingDB
DrugBank Target Actions (2)
Target Gene Target Name Action Type
P18405 SRD5A1 3-oxo-5-alpha-steroid 4-dehydrogenase 1 inhibitor targets
P31213 SRD5A2 3-oxo-5-alpha-steroid 4-dehydrogenase 2 inhibitor targets