Compound Detail
CHEMBL426078
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Basic Information
| ChEMBL ID | CHEMBL426078 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GUXYHZUGDWFOBA-GHXNOFRVSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
254.3
MW (Da)
2.83
ALogP
2
HBA
3
HBD
65.1
PSA (Ų)
0.54
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.0 | 7.0 | 100.0 | 1 |
| PBMC CHEMBL613107 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| 3-phosphoinositide-dependent protein kinase 1 CHEMBL2534 | IC50 | 5.96 | 5.96 | 1100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 100.0 | nM | 7.0 | In vitro inhibition of KDR | 16107139 |
| PBMC | IC50 | = | 1000.0 | nM | 6.0 | In vitro inhibitory concentration on the production of pro-inflammatory cytokine... | 16107139 |
| 3-phosphoinositide-dependent protein kinase 1 | IC50 | = | 1100.0 | nM | 5.96 | Inhibition of PDK1 mediated cAKT2 phosphorylation by AKT2 activation assay | 17531483 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16107139 | 10.1021/jm0504151 | Mus musculus | 1 |
| 16107139 | 10.1021/jm0504151 | Vascular endothelial growth factor receptor 2 | 1 |
| 16107139 | 10.1021/jm0504151 | PBMC | 1 |
| 17531483 | 10.1016/j.bmcl.2007.04.071 | 3-phosphoinositide-dependent protein kinase 1 | 1 |
Data from ChEMBL 36 via Core Engine