Compound Detail
CHEMBL59422
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Basic Information
| ChEMBL ID | CHEMBL59422 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PWTCCMJTPHCGMS-NEQMZLFVSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
398.6
MW (Da)
5.49
ALogP
5
HBA
1
HBD
72.8
PSA (Ų)
0.18
QED
1
Ro5 Violations
19
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein kinase C alpha type CHEMBL2213 | Ki | 7.3 | 7.3 | 50.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein kinase C alpha type | Ki | = | 50.4 | nM | 7.3 | Ability to displace bound [20-3H]-PDBU from a recombinant single isozyme (PKCalp... | 11384235 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11384235 | 10.1021/jm010052e | No relevant target | 1 |
| 11384235 | 10.1021/jm010052e | Protein kinase C alpha type | 1 |
Data from ChEMBL 36 via Core Engine