Compound Detail
CHEMBL523571
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Basic Information
| ChEMBL ID | CHEMBL523571 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LHVLYDTWLCHLHP-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
291.3
MW (Da)
2.79
ALogP
4
HBA
2
HBD
70.9
PSA (Ų)
0.57
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.24
EC50 1 meas. best 5.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | EC50 | 5.34 | 5.34 | 4600.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.24 | 5.24 | 5800.0 | 1 |
| Platelet-derived growth factor receptor beta CHEMBL1913 | IC50 | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | EC50 | = | 4600.0 | nM | 5.34 | Inhibition of VEGF-mediated proliferation of HMVEC after 72 hrs | 19113866 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 5800.0 | nM | 5.24 | Inhibition of human recombinant VEGFR2 | 19113866 |
| Platelet-derived growth factor receptor beta | IC50 | = | 19000.0 | nM | 4.72 | Inhibition of human recombinant PDGFRbeta | 19113866 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19113866 | 10.1021/jm800790t | Vascular endothelial growth factor receptor 2 | 1 |
| 19113866 | 10.1021/jm800790t | Fibroblast growth factor receptor 1 | 1 |
| 19113866 | 10.1021/jm800790t | Platelet-derived growth factor receptor beta | 1 |
| 19113866 | 10.1021/jm800790t | NON-PROTEIN TARGET | 1 |
| 38318365 | 10.1016/j.isci.2024.108907 | Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 | 1 |
Data from ChEMBL 36 via Core Engine