Compound Detail
CHEMBL3621299
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Basic Information
| ChEMBL ID | CHEMBL3621299 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ABLAJTWOWSSMFU-WJDWOHSUSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
369.5
MW (Da)
3.61
ALogP
3
HBA
3
HBD
74.0
PSA (Ų)
0.54
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 8.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Platelet-derived growth factor receptor beta CHEMBL1913 | IC50 | 8.1 | 8.1 | 8.0 | 1 |
| Platelet-derived growth factor receptor alpha CHEMBL2007 | IC50 | 7.93 | 7.93 | 11.8 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 7.42 | 7.42 | 38.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Platelet-derived growth factor receptor beta | IC50 | = | 8.0 | nM | 8.1 | Inhibition of PDGFRb (unknown origin) | - |
| Platelet-derived growth factor receptor alpha | IC50 | = | 11.8 | nM | 7.93 | Inhibition of PDGFRa (unknown origin) | - |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 38.0 | nM | 7.42 | Inhibition of VEGFR2 (unknown origin) | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C4MD00211C | Platelet-derived growth factor receptor beta | 1 |
| - | 10.1039/C4MD00211C | Platelet-derived growth factor receptor alpha | 1 |
| - | 10.1039/C4MD00211C | Vascular endothelial growth factor receptor 2 | 1 |
| - | 10.1039/C4MD00211C | Vascular endothelial growth factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine