Compound Detail
CHEMBL470532
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Basic Information
| ChEMBL ID | CHEMBL470532 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SOAHRORIZWYEIR-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
401.5
MW (Da)
4.44
ALogP
4
HBA
2
HBD
79.5
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL3910 | IC50 | 6.36 | 6.36 | 440.0 | 1 |
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL4235 | IC50 | 6.07 | 6.07 | 850.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 | IC50 | = | 440.0 | nM | 6.36 | Inhibition of mouse 11beta-HSD1 expressed in HEK293 cells assessed as conversion... | 18653260 |
| 11-beta-hydroxysteroid dehydrogenase 1 | IC50 | = | 850.0 | nM | 6.07 | Inhibition of human 11beta-HSD1 expressed in HEK293 cells assessed as conversion... | 18653260 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18653260 | 10.1016/j.ejmech.2008.06.005 | 11-beta-hydroxysteroid dehydrogenase 1 | 4 |
| 18653260 | 10.1016/j.ejmech.2008.06.005 | 11-beta-hydroxysteroid dehydrogenase type 2 | 2 |
Data from ChEMBL 36 via Core Engine