Compound Detail
CHEMBL60541
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Basic Information
| ChEMBL ID | CHEMBL60541 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LMHJODWZPPIPQX-GHXNOFRVSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
373.4
MW (Da)
1.13
ALogP
5
HBA
3
HBD
117.4
PSA (Ų)
0.55
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cyclin-dependent kinase 2 CHEMBL301 | IC50 | 8.4 | 8.4 | 4.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.18 | 5.18 | 6600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cyclin-dependent kinase 2 | IC50 | = | 4.0 | nM | 8.4 | Inhibitory activity against Cyclin-dependent kinase 2 | 12749903 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 6600.0 | nM | 5.18 | Inhibitory activity was tested against FLK kinase | 12749903 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12749903 | 10.1016/s0960-894x(03)00312-3 | Cyclin-dependent kinase 2 | 1 |
| 12749903 | 10.1016/s0960-894x(03)00312-3 | Vascular endothelial growth factor receptor 2 | 1 |
| 12749903 | 10.1016/s0960-894x(03)00312-3 | Platelet-derived growth factor receptor beta | 1 |
| 12749903 | 10.1016/s0960-894x(03)00312-3 | Proto-oncogene tyrosine-protein kinase Src | 1 |
Data from ChEMBL 36 via Core Engine