Compound Detail
CHEMBL386630
TESTOSTERONE 💊 Approved Drug
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💊 Approved Drug
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O
Basic Information
| ChEMBL ID | CHEMBL386630 |
| Name | TESTOSTERONE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | MUMGGOZAMZWBJJ-DYKIIFRCSA-N |
| Therapeutic | ✓ Yes |
18
Targets
52
Activities
4
Assay Types
30
PK Parameters
20
Publications
30
Known Names
20
Indications
1
Mechanisms
Molecular Properties
288.4
MW (Da)
3.88
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1972 |
| Availability | Prescription |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Androgen Receptor agonist | AGONIST | Androgen receptor | ✓ | ✓ |
Indications
Hypogonadism Hypogonadism Klinefelter Syndrome Neoplasms Neoplasms Orchitis Sexual Dysfunctions, Psychological Sexual Dysfunctions, Psychological Coronary Disease Disorders of Sex Development Erectile Dysfunction Hip Fractures Infertility Kidney Failure, Chronic Menopause Metabolic Syndrome Acquired Immunodeficiency Syndrome Anorexia Nervosa Carcinoma, Intraductal, Noninfiltrating Dwarfism
ATC Classification
G03BA03
testosterone
Level 1: GENITO URINARY SYSTEM AND SEX HORMONES
Level 2: SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
Drug Warnings
Black Box Warning
General Warning
Activity Summary
IC50 29 meas. best 8.57
Ki 16 meas. best 8.85
EC50 5 meas. best 8.96
Kd 2 meas. best 9.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Androgen receptor CHEMBL1871 | Kd | 9.4 | 9.4 | 0.4 | 1 |
| Sex hormone-binding globulin CHEMBL3305 | Kd | 9.2 | 9.2 | 0.6 | 1 |
| Androgen receptor CHEMBL1871 | EC50 | 8.96 | 8.7267 | 1.1 | 3 |
| Androgen receptor CHEMBL3072 | Ki | 8.85 | 8.5133 | 1.4 | 6 |
| Androgen receptor CHEMBL3056 | EC50 | 8.7 | 8.7 | 2.0 | 1 |
| Androgen receptor CHEMBL1871 | IC50 | 8.57 | 8.3413 | 2.7 | 8 |
| Androgen receptor CHEMBL3072 | IC50 | 8.49 | 7.6 | 3.2 | 4 |
| Androgen receptor CHEMBL3056 | IC50 | 7.96 | 7.96 | 11.0 | 1 |
| Sex hormone-binding globulin CHEMBL3305 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
| Androgen receptor CHEMBL1871 | Ki | 7.54 | 7.54 | 29.0 | 1 |
| Voltage-dependent L-type calcium channel subunit alpha-1C CHEMBL1940 | IC50 | 7.47 | 7.445 | 34.0 | 2 |
| Cytochrome P450 3A4 CHEMBL340 | IC50 | 7.43 | 6.9517 | 37.0 | 6 |
| Corticosteroid-binding globulin CHEMBL2421 | Ki | 6.72 | 6.72 | 190.6 | 1 |
| Progesterone receptor CHEMBL1909044 | Ki | 6.6 | 6.6 | 252.0 | 1 |
| Aromatase CHEMBL1978 | Ki | 6.22 | 6.22 | 600.0 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 5.92 | 5.92 | 1200.0 | 1 |
| Glucocorticoid receptor CHEMBL2034 | Ki | 5.84 | 5.84 | 1457.0 | 1 |
| Steroid 5-alpha-reductase CHEMBL2096664 | IC50 | 5.72 | 5.72 | 1900.0 | 1 |
| Progesterone receptor CHEMBL1909044 | IC50 | 5.71 | 5.71 | 1935.0 | 1 |
| Glucocorticoid receptor CHEMBL2034 | IC50 | 5.49 | 5.49 | 3206.0 | 1 |
| Solute carrier organic anion transporter family member 1A1 CHEMBL1781859 | Ki | 5.27 | 5.27 | 5400.0 | 1 |
| C-8 sterol isomerase ERG2 CHEMBL3224 | Ki | 5.11 | 5.11 | 7760.0 | 1 |
| G-protein coupled bile acid receptor 1 CHEMBL5409 | EC50 | 4.74 | 4.74 | 18300.0 | 1 |
| Nuclear receptor subfamily 1 group I member 3 CHEMBL3069 | IC50 | 4.52 | 4.52 | 30000.0 | 1 |
| Lanosterol 14-alpha demethylase CHEMBL3849 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
| Alpha-synuclein CHEMBL6152 | IC50 | 4.01 | 4.01 | 96800.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 43.33 | ng.hr.mL-1 | Mus musculus |
| AUC | 1.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 145.0 | ng.hr.mL-1 | Macaca fascicularis |
| Cavg | 365.0 | ng/dL | Homo sapiens |
| Cavg | 612.0 | ng/dL | Homo sapiens |
| CL | 109.3 | mL.min-1.g-1 | Homo sapiens |
| CL | 375.6 | mL.min-1.g-1 | Rattus norvegicus |
| CL | 312.6 | mL.min-1.g-1 | Mus musculus |
| CL | 150.0 | uL.min-1.(10^6cells)-1 | Homo sapiens |
| CL | 692.1 | mL.min-1.g-1 | Mus musculus |
| CL | 2725.1 | mL.min-1.kg-1 | Mus musculus |
| CL | 87.1 | mL.min-1.kg-1 | Mus musculus |
| CL | 1421.4 | mL.min-1.g-1 | Rattus norvegicus |
| CL | 92.0 | mL.min-1.g-1 | Homo sapiens |
| CL | 46.9 | mL.min-1.kg-1 | Homo sapiens |
| CL | 96.0 | mL.min-1.g-1 | Homo sapiens |
| CL | 82.2 | mL.min-1.g-1 | Homo sapiens |
| CL | 74.0 | mL.min-1.kg-1 | Homo sapiens |
| CL | 86.3 | mL.min-1.kg-1 | Homo sapiens |
| CL | 95.9 | mL.min-1.g-1 | Homo sapiens |
| CL | 70.1 | mL.min-1.g-1 | Homo sapiens |
| CL | 0.0631 | mL.min-1.kg-1 | Homo sapiens |
| CL | 106.0 | mL.min-1.g-1 | Homo sapiens |
| CL | 95.4 | mL.min-1.kg-1 | Homo sapiens |
| CL | 95.2 | mL.min-1.g-1 | Homo sapiens |
| CL | 85.7 | mL.min-1.kg-1 | Homo sapiens |
| CL | 0.0911 | mL.min-1.kg-1 | Homo sapiens |
| CL | 3.776 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 71.3 | mL.min-1.g-1 | Homo sapiens |
| CL | 478.8 | mL.min-1.g-1 | Mus musculus |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine