Molecule Details
| InChIKey | NVKAWKQGWWIWPM-ABEVXSGRSA-N |
|---|---|
| Compound Name | Dihydrotestosterone |
| Canonical SMILES | C[C@]12CCC(=O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.43 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB02901 |
|---|---|
| Drug Name | Stanolone |
| CAS Number | 521-18-6 |
| Groups | illicit investigational |
| ATC Codes | A14AA01 G03BB02 |
| Description | A potent androgenic metabolite of testosterone. Dihydrotestosterone (DHT) is generated by a 5-alpha reduction of testosterone. Unlike testosterone, DHT cannot be aromatized to estradiol therefore DHT is considered a pure androgenic steroid. |
Categories: 5-Androstanon (3) Derivatives Alimentary Tract and Metabolism Anabolic Agents for Systemic Use Anabolic Steroids Androgens Androstan Derivatives Androstanes Androstanols Fused-Ring Compounds Genito Urinary System and Sex Hormones Gonadal Hormones Gonadal Steroid Hormones Hormones Hormones, Hormone Substitutes, and Hormone Antagonists P-glycoprotein substrates Sex Hormones and Modulators of the Genital System Steroids Testosterone Congeners Testosterone and derivatives Thyroxine-binding globulin inhibitors
Cross-references: BindingDB: 50366473 ChEBI: 16330 CHEMBL27769 ChemSpider: 10189 C03917 D07456 PDB: DHT PubChem:10635 PubChem:46506828 RxCUI: 236781 Wikipedia: Dihydrotestosterone ZINC: ZINC000003814360
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P04278 | SHBG | Homo sapiens | Human | PF00054 | 9.1 | IC50 | ChEMBL;BindingDB |
| P10275 | AR | Homo sapiens | Human | PF02166 PF00104 PF00105 | 8.7 | Ki | ChEMBL;BindingDB |
| P11511 | CYP19A1 | Homo sapiens | Human | PF00067 | 6.7 | Ki | ChEMBL;BindingDB |
| P08235 | NR3C2 | Homo sapiens | Human | PF00104 PF00105 | 6.4 | IC50 | ChEMBL;BindingDB |
| P04150 | NR3C1 | Homo sapiens | Human | PF02155 PF00104 PF00105 | 6.3 | IC50 | ChEMBL;BindingDB |
DrugBank Target Actions (10)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P04278 | SHBG | Sex hormone-binding globulin | binder | carriers |
| P42330 | AKR1C3 | Aldo-keto reductase family 1 member C3 | product of | enzymes |
| P05093 | CYP17A1 | Steroid 17-alpha-hydroxylase/17,20 lyase | substrate | enzymes |
| P05108 | P05108 | Cholesterol side-chain cleavage enzyme, mitochondrial | substrate | enzymes |
| P11511 | CYP19A1 | Aromatase | substrate | enzymes |
| P10275 | AR | Androgen receptor | agonist | targets |
| P03372 | ESR1 | Estrogen receptor | binder | targets |
| P08235 | NR3C2 | Mineralocorticoid receptor | binder | targets |
| P14061 | HSD17B1 | 17-beta-hydroxysteroid dehydrogenase type 1 | binder | targets |
| P08183 | ABCB1 | ATP-dependent translocase ABCB1 | substrate | transporters |