Molecule Details
| InChIKey | WZDGZWOAQTVYBX-XOINTXKNSA-N |
|---|---|
| Compound Name | Tibolone |
| Canonical SMILES | C#C[C@]1(O)CC[C@H]2[C@@H]3[C@H](C)CC4=C(CCC(=O)C4)[C@H]3CC[C@@]21C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.91 |
| Source | ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB09070 |
|---|---|
| Drug Name | Tibolone |
| CAS Number | 5630-53-5 |
| Groups | approved investigational |
| ATC Codes | G03CX01 |
| Description | Tibolone is a synthetic steroid hormone drug, which is mainly non-selective in its binding profile, acting as an agonist primarily at estrogen receptors (ER), with a preference for ER alpha [L1874]. Tibolone (Livial, Org OD 14), produced by Organon (West Orange, NJ), is a synthetic steroid that poss... |
Categories: Anabolic Agents Antineoplastic Agents, Hormonal Cardiovascular Agents Estrogen Receptor Modulators Estrogens Estrogens, Antiestrogens, and Estrogen Agonist-Antagonists Fused-Ring Compounds Genito Urinary System and Sex Hormones Hormone Antagonists Hormones Hormones, Hormone Substitutes, and Hormone Antagonists Norpregnanes Norsteroids Sex Hormones and Modulators of the Genital System Steroids
Cross-references: ChEBI: 32223 CHEMBL2103774 ChemSpider: 392038 Drugs Product Database (DPD): 1251 D01639 PubChem:444008 PubChem:347827821 RxCUI: 38260 Wikipedia: Tibolone ZINC: ZINC000003812889
Target Activities (2)
DrugBank Target Actions (7)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P02768 | ALB | Albumin | binder | carriers |
| P08842 | STS | Steryl-sulfatase | inhibitor | enzymes |
| P14060 | HSD3B1 | 3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase type 1 | substrate | enzymes |
| P26439 | P26439 | 3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase type 2 | substrate | enzymes |
| P50225 | SULT1A1 | Sulfotransferase 1A1 | substrate | enzymes |
| P03372 | ESR1 | Estrogen receptor | agonist | targets |
| P03372 | ESR1 | Estrogen receptor | antagonist | targets |