Molecule Details
| InChIKey | METQSPRSQINEEU-HXCATZOESA-N |
|---|---|
| Compound Name | Drospirenone |
| Canonical SMILES | C[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 pChEMBL | 7.35 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB01395 |
|---|---|
| Drug Name | Drospirenone |
| CAS Number | 67392-87-4 |
| Groups | approved investigational |
| ATC Codes | G03AA18 G03AC10 G03FA17 G03AA12 |
| Description | Drospirenone 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)
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 |