Compound Detail
CHEMBL710
FINASTERIDE 💊 Approved Drug
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💊 Approved Drug
CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C
Basic Information
| ChEMBL ID | CHEMBL710 |
| Name | FINASTERIDE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | DBEPLOCGEIEOCV-WSBQPABSSA-N |
| Therapeutic | ✓ Yes |
17
Targets
105
Activities
2
Assay Types
30
PK Parameters
20
Publications
10
Known Names
12
Indications
1
Mechanisms
Molecular Properties
372.6
MW (Da)
3.81
ALogP
2
HBA
2
HBD
58.2
PSA (Ų)
0.74
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 1992 |
| Availability | Prescription |
| Chirality | Single Enantiomer |
Mechanism of Action
| Mechanism | Action Type | Target | Direct | Efficacy |
|---|---|---|---|---|
| Steroid 5-alpha-reductase 2 inhibitor | INHIBITOR | 3-oxo-5-alpha-steroid 4-dehydrogenase 2 | ✓ | ✓ |
Indications
Alopecia Alopecia Alopecia Prostatic Hyperplasia Prostatic Neoplasms Prostatic Neoplasms Acne Vulgaris Carcinoma, Non-Small-Cell Lung Prostatic Neoplasms, Castration-Resistant Retinal Diseases Hypogonadism Hyperplasia
ATC Classification
D11AX10
finasteride
Level 1: DERMATOLOGICALS
Level 2: OTHER DERMATOLOGICAL PREPARATIONS
G04CB01
finasteride
Level 1: GENITO URINARY SYSTEM AND SEX HORMONES
Level 2: UROLOGICALS
Activity Summary
IC50 92 meas. best 9.74
Ki 13 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 3-oxo-5-alpha-steroid 4-dehydrogenase 2 CHEMBL1856 | IC50 | 9.74 | 8.3433 | 0.2 | 27 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 2 CHEMBL5099 | IC50 | 9.55 | 7.504 | 0.3 | 5 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 2 CHEMBL1856 | Ki | 8.7 | 8.7 | 2.0 | 1 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 1 CHEMBL3422 | IC50 | 8.38 | 7.075 | 4.2 | 4 |
| Steroid 5-alpha-reductase CHEMBL2096664 | IC50 | 8.17 | 8.17 | 6.8 | 1 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 1 CHEMBL3422 | Ki | 8.17 | 8.17 | 6.8 | 1 |
| Unchecked CHEMBL612545 | IC50 | 8.0 | 6.38 | 10.0 | 9 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 1 CHEMBL1787 | IC50 | 7.58 | 6.6691 | 26.3 | 22 |
| Unchecked CHEMBL612545 | Ki | 7.26 | 6.21 | 54.7 | 5 |
| Steroid 5-alpha-reductase CHEMBL2096664 | Ki | 7.26 | 7.155 | 54.7 | 2 |
| 3-oxo-5-alpha-steroid 4-dehydrogenase 1 CHEMBL1787 | Ki | 7.0 | 6.7533 | 100.0 | 3 |
| Cytochrome P450 2C19 CHEMBL3622 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Cytochrome P450 2C9 CHEMBL3397 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
| DU-145 CHEMBL613508 | IC50 | 5.41 | 5.1325 | 3900.0 | 4 |
| Plasmodium falciparum CHEMBL364 | IC50 | 5.1 | 5.0333 | 7943.3 | 3 |
| 3 beta-hydroxysteroid dehydrogenase/Delta 5-->4-isomerase type 1 CHEMBL1958 | Ki | 4.96 | 4.96 | 11000.0 | 1 |
| LNCaP CHEMBL612518 | IC50 | 4.87 | 4.855 | 13530.0 | 2 |
| PC-3 CHEMBL390 | IC50 | 4.75 | 4.75 | 17800.0 | 3 |
| Bile salt export pump CHEMBL6020 | IC50 | 4.55 | 4.55 | 28200.0 | 3 |
| ADMET CHEMBL612558 | IC50 | 4.55 | 4.55 | 28200.0 | 1 |
| MCF7 CHEMBL387 | IC50 | 4.36 | 4.36 | 44140.0 | 1 |
| ATP-binding cassette sub-family C member 4 CHEMBL1743128 | IC50 | 4.29 | 4.29 | 51000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 447.06 | ng.hr.mL-1 | Sus scrofa |
| AUC | 335.3 | ng.hr.mL-1 | Sus scrofa |
| AUC | 447.06 | ng.hr.mL-1 | Sus scrofa |
| AUC | 931.38 | ng.hr.mL-1 | Sus scrofa |
| AUC | 1564.71 | ng.hr.mL-1 | Sus scrofa |
| AUC | 409.81 | ng.hr.mL-1 | Sus scrofa |
| AUC | 1080.39 | ng.hr.mL-1 | Sus scrofa |
| AUC | 596.08 | ng.hr.mL-1 | Sus scrofa |
| AUC | 633.34 | ng.hr.mL-1 | Sus scrofa |
| AUC | 2347.07 | ng.hr.mL-1 | Sus scrofa |
| AUC | 1527.45 | ng.hr.mL-1 | Sus scrofa |
| AUC | 1639.22 | ng.hr.mL-1 | Sus scrofa |
| AUC | 369.94 | ng.hr.mL-1 | Homo sapiens |
| AUC | 369.94 | ng.hr.mL-1 | Homo sapiens |
| AUC | 23.48 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 23.79 | ng.hr.mL-1 | Rattus norvegicus |
| CL | 2.4 | mL.min-1.kg-1 | Homo sapiens |
| CL | 2.4 | mL.min-1.kg-1 | Homo sapiens |
| CL | 2.4 | mL.min-1.kg-1 | Homo sapiens |
| CL | 2.4 | mL.min-1.kg-1 | Homo sapiens |
| CL | 25.0 | mL.min-1.kg-1 | Sus scrofa |
| CL | 18.0 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.009 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.01 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.014 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.005 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.006 | mL.min-1.kg-1 | Sus scrofa |
| CL | 0.01 | mL.min-1.kg-1 | Sus scrofa |
| CL | 2.333 | mL.min-1.kg-1 | Homo sapiens |
| CL | 7.0 | mL.min-1.kg-1 | Sus scrofa |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine