Compound Detail
CHEMBL437369
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL437369 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BTAQQMMTAQWGCF-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
447.8
MW (Da)
5.79
ALogP
5
HBA
3
HBD
106.1
PSA (Ų)
0.37
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 1 CHEMBL1868 | IC50 | 6.73 | 6.73 | 186.2 | 1 |
| Angiopoietin-1 receptor CHEMBL4128 | IC50 | 6.69 | 6.69 | 204.2 | 1 |
| Receptor-interacting serine/threonine-protein kinase 1 CHEMBL5464 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 1 | IC50 | = | 186.21 | nM | 6.73 | Inhibition of human VEGFR2 by HTRF method | 17276055 |
| Angiopoietin-1 receptor | IC50 | = | 204.17 | nM | 6.69 | Inhibition of human Tie2 by HTRF method | 17276055 |
| Receptor-interacting serine/threonine-protein kinase 1 | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of human N-terminal His-GST-TEV-fused RIP1 kinase domain (1 to 375) a... | 24900635 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24900635 | 10.1021/ml400382p | Receptor-interacting serine/threonine-protein kinase 1 | 5 |
| 17276055 | 10.1016/j.bmcl.2006.12.077 | Angiopoietin-1 receptor | 1 |
| 17276055 | 10.1016/j.bmcl.2006.12.077 | Vascular endothelial growth factor receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine