Compound Detail
CHEMBL488834
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Basic Information
| ChEMBL ID | CHEMBL488834 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WKRGWNGOAPQILF-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
380.5
MW (Da)
3.92
ALogP
4
HBA
3
HBD
97.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| UT7 CHEMBL614057 | IC50 | 7.85 | 7.85 | 14.0 | 1 |
| Mast/stem cell growth factor receptor Kit CHEMBL1936 | IC50 | 7.46 | 7.46 | 35.0 | 1 |
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 6.74 | 6.74 | 181.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| UT7 | IC50 | = | 14.0 | nM | 7.85 | Antiproliferative activity against stem cell factor-stimulated human UT7 cells | 18554909 |
| Mast/stem cell growth factor receptor Kit | IC50 | = | 35.0 | nM | 7.46 | Inhibition of c-kit | 18554909 |
| Mitogen-activated protein kinase 14 | IC50 | = | 181.0 | nM | 6.74 | Inhibition of p38alpha | 18554909 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18554909 | 10.1016/j.bmcl.2008.05.089 | Unchecked | 2 |
| 18554909 | 10.1016/j.bmcl.2008.05.089 | Vascular endothelial growth factor receptor 2 | 1 |
| 18554909 | 10.1016/j.bmcl.2008.05.089 | Mitogen-activated protein kinase 14 | 1 |
| 18554909 | 10.1016/j.bmcl.2008.05.089 | Mast/stem cell growth factor receptor Kit | 1 |
| 18554909 | 10.1016/j.bmcl.2008.05.089 | UT7 | 1 |
Data from ChEMBL 36 via Core Engine