Compound Detail
CHEMBL1651522
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Basic Information
| ChEMBL ID | CHEMBL1651522 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMEZKJBCLUGJTN-RRNHBABESA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
12
Publications
0
Known Names
Molecular Properties
348.4
MW (Da)
2.55
ALogP
6
HBA
2
HBD
93.1
PSA (Ų)
0.76
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Platelet-derived growth factor receptor alpha CHEMBL2007 | IC50 | 6.75 | 6.75 | 180.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 6.72 | 6.72 | 190.0 | 1 |
| Mast/stem cell growth factor receptor Kit CHEMBL1936 | IC50 | 5.12 | 5.12 | 7600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Platelet-derived growth factor receptor alpha | IC50 | = | 180.0 | nM | 6.75 | Inhibition of PDGFRalpha V561D mutant by TR-FRET based LanthaScreen assay | 24900250 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 190.0 | nM | 6.72 | Inhibition of VEGFR2 by TR-FRET based LanthaScreen assay | 24900250 |
| Mast/stem cell growth factor receptor Kit | IC50 | = | 7600.0 | nM | 5.12 | Inhibition of cKIT by TR-FRET based LanthaScreen assay | 24900250 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900250 | 10.1021/ml1001807 | ALK tyrosine kinase receptor | 1 |
| 24900250 | 10.1021/ml1001807 | Mitogen-activated protein kinase 1 | 1 |
| 24900250 | 10.1021/ml1001807 | Ephrin type-B receptor 4 | 1 |
| 24900250 | 10.1021/ml1001807 | Mast/stem cell growth factor receptor Kit | 1 |
| 24900250 | 10.1021/ml1001807 | Tyrosine-protein kinase Lck | 1 |
| 24900250 | 10.1021/ml1001807 | Dual specificity mitogen-activated protein kinase kinase 2 | 1 |
| 24900250 | 10.1021/ml1001807 | MAP kinase-activated protein kinase 5 | 1 |
| 24900250 | 10.1021/ml1001807 | MAP kinase-interacting serine/threonine-protein kinase 2 | 1 |
| 24900250 | 10.1021/ml1001807 | Platelet-derived growth factor receptor alpha | 1 |
| 24900250 | 10.1021/ml1001807 | Proto-oncogene tyrosine-protein kinase receptor Ret | 1 |
| 24900250 | 10.1021/ml1001807 | Non-receptor tyrosine-protein kinase TYK2 | 1 |
| 24900250 | 10.1021/ml1001807 | Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine