Compound Detail
CHEMBL1088517
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL1088517 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DKFPJVQUCNQTLS-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
305.4
MW (Da)
2.26
ALogP
4
HBA
0
HBD
49.6
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.54
Ki 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL4235 | Ki | 7.82 | 7.82 | 15.0 | 1 |
| 11-beta-hydroxysteroid dehydrogenase 1 CHEMBL4235 | IC50 | 6.54 | 6.54 | 290.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 11-beta-hydroxysteroid dehydrogenase 1 | Ki | = | 15.0 | nM | 7.82 | Inhibition of human 11-beta-HSD1 | 20363126 |
| 11-beta-hydroxysteroid dehydrogenase 1 | IC50 | = | 290.0 | nM | 6.54 | Inhibition of human 11-beta-HSD1 expressed in HEK293 cells co-transfected with G... | 20363126 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20363126 | 10.1016/j.bmcl.2010.03.032 | 11-beta-hydroxysteroid dehydrogenase 1 | 3 |
Data from ChEMBL 36 via Core Engine