Compound Detail
CHEMBL471137
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
COc1ccc(/C=C2\CC(CO)(COC(=O)c3c(C(C)C)cc(C(C)C)cc3C(C)C)OC2=O)cc1
Basic Information
| ChEMBL ID | CHEMBL471137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GYKDPGRXKGXJRX-FSJBWODESA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
494.6
MW (Da)
5.98
ALogP
6
HBA
1
HBD
82.1
PSA (Ų)
0.34
QED
1
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C alpha type CHEMBL2567 | Ki | 8.1 | 7.405 | 8.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C alpha type | Ki | = | 8.0 | nM | 8.1 | Displacement of [3H]PDBu form mouse PKCalpha by scintillation counting | 18698758 |
| Protein kinase C alpha type | Ki | = | 197.0 | nM | 6.71 | Displacement of [3H]PDBu form mouse PKCalpha by scintillation counting | 18698758 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18698758 | 10.1021/jm8001907 | Protein kinase C alpha type | 2 |
Data from ChEMBL 36 via Core Engine