Molecule Details
InChIKeyMETQSPRSQINEEU-HXCATZOESA-N
Compound NameDrospirenone
Canonical SMILESC[C@]12CCC(=O)C=C1[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.35
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB01395
Drug NameDrospirenone
CAS Number67392-87-4
Groups approved investigational
ATC Codes G03AA18 G03AC10 G03FA17 G03AA12
DescriptionDrospirenone is a synthetic progestin commonly found in the popular oral contraceptive, Yaz in combination with [Ethinyl estradiol].[L7973] Most recently, it was approved by both Health Canada and the FDA in combination with [Estetrol] as an oral contraceptive therapy.[L33199,L33174] Aside from its ...

Categories: Adrenal Cortex Hormones Agents causing hyperkalemia Androstanes Combination Contraceptives (with Estrogen and derivatives) Contraceptive Agents, Female Contraceptives, Oral Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 CYP3A4 Substrates (strength unknown) Cytochrome P-450 Substrates Diuretics Fused-Ring Compounds Genito Urinary System and Sex Hormones Hormonal Contraceptives for Systemic Use Hormone Antagonists Hormones, Hormone Substitutes, and Hormone Antagonists Hyperglycemia-Associated Agents Mineralocorticoid Receptor Antagonists Natriuretic Agents Progesterone Congeners Progestin Contraceptives Progestins Sex Hormones and Modulators of the Genital System Steroids
Cross-references: BindingDB: 150275 ChEBI: 50838 CHEMBL1509 ChemSpider: 62105 Drugs Product Database (DPD): 13375 D03917 PharmGKB: PA164749409 PubChem:68873 PubChem:46507653 RxCUI: 11636 Therapeutic Targets Database: DAP001206 Wikipedia: Drospirenone ZINC: ZINC000003927200
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P08235 NR3C2 Homo sapiens Human PF00104 PF00105 8.5 IC50 BindingDB
P06401 PGR Homo sapiens Human PF00104 PF02161 PF00105 7.4 IC50 ChEMBL;BindingDB
P10275 AR Homo sapiens Human PF02166 PF00104 PF00105 6.2 IC50 ChEMBL;BindingDB
DrugBank Target Actions (8)
Target Gene Target Name Action Type
P35354 PTGS2 Prostaglandin G/H synthase 2 inducer enzymes
P35354 PTGS2 Prostaglandin G/H synthase 2 inhibitor enzymes
P08684 CYP3A4 Cytochrome P450 3A4 substrate enzymes
P27169 P27169 Serum paraoxonase/arylesterase 1 substrate enzymes
P06401 PGR Progesterone receptor agonist targets
P08235 NR3C2 Mineralocorticoid receptor antagonist targets
P10275 AR Androgen receptor antagonist targets
P04150 NR3C1 Glucocorticoid receptor binder targets