Compound Detail
CHEMBL334555
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Basic Information
| ChEMBL ID | CHEMBL334555 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RZWOMXWGNHPLAV-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
442.5
MW (Da)
2.61
ALogP
7
HBA
1
HBD
87.4
PSA (Ų)
0.42
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.86
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 6.86 | 6.86 | 138.0 | 1 |
| Protein kinase C gamma type CHEMBL2938 | IC50 | 5.57 | 5.57 | 2670.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 138.0 | nM | 6.86 | Inhibition of Glycogen synthase kinase-3beta (GSK3-beta) | 12954055 |
| Protein kinase C gamma type | IC50 | = | 2670.0 | nM | 5.57 | Inhibition of Protein kinase C gamma (PKC-gamma) | 12954055 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12954055 | 10.1021/jm030115o | Protein kinase C gamma type | 1 |
| 12954055 | 10.1021/jm030115o | Glycogen synthase kinase-3 beta | 1 |
Data from ChEMBL 36 via Core Engine