Compound Detail
CHEMBL26050
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Basic Information
| ChEMBL ID | CHEMBL26050 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CGRPEMVYTZGPEU-UHFFFAOYSA-N |
3
Targets
6
Activities
1
Assay Types
0
PK Parameters
11
Publications
0
Known Names
Molecular Properties
416.9
MW (Da)
4.65
ALogP
6
HBA
1
HBD
59.5
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 1 CHEMBL1868 | IC50 | 5.82 | 5.32 | 1500.0 | 2 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.82 | 5.82 | 1500.0 | 2 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 4.4 | 4.35 | 40000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 1 | IC50 | = | 1500.0 | nM | 5.82 | Inhibition of fms-like tyrosine kinase receptor (Flt-1) kinase activity at a con... | 11881999 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 1500.0 | nM | 5.82 | Inhibition of vascular endothelial growth factor receptor 2 kinase activity at a... | 11881999 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 1500.0 | nM | 5.82 | Vascular endothelial growth factor receptor 2 inhibitory activity at 2 uM of ATP... | 10639280 |
| Vascular endothelial growth factor receptor 1 | IC50 | = | 15000.0 | nM | 4.82 | In vitro vascular endothelial growth factor receptor 1 inhibitory activity at 2 ... | 10639280 |
| Fibroblast growth factor receptor 1 | IC50 | = | 40000.0 | nM | 4.4 | FGFR-1 (FTK) inhibitory activity at 2 uM of ATP in vitro. | 10639280 |
| Fibroblast growth factor receptor 1 | IC50 | = | 50000.0 | nM | 4.3 | Inhibition fibroblast growth factor receptor TK kinase activity at a concentrati... | 11881999 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11881999 | 10.1021/jm011022e | Epidermal growth factor receptor | 2 |
| 11881999 | 10.1021/jm011022e | Vascular endothelial growth factor receptor 1 | 1 |
| 11881999 | 10.1021/jm011022e | Vascular endothelial growth factor receptor 2 | 1 |
| 11881999 | 10.1021/jm011022e | Fibroblast growth factor receptor 1 | 1 |
| 11881999 | 10.1021/jm011022e | Vascular endothelial growth factor receptor | 1 |
| 11881999 | 10.1021/jm011022e | HUVEC | 1 |
| 10639280 | 10.1021/jm990345w | Vascular endothelial growth factor receptor 1 | 1 |
| 10639280 | 10.1021/jm990345w | Vascular endothelial growth factor receptor 2 | 1 |
| 10639280 | 10.1021/jm990345w | Fibroblast growth factor receptor 1 | 1 |
| 10639280 | 10.1021/jm990345w | Unchecked | 1 |
| 10639280 | 10.1021/jm990345w | VEGF-receptor 2 and Fibroblast growth factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine