Compound Detail
CHEMBL18852
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Basic Information
| ChEMBL ID | CHEMBL18852 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FETIVRQJTSQCQU-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
343.4
MW (Da)
4.06
ALogP
4
HBA
2
HBD
72.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 6.4 | 6.4 | 400.0 | 1 |
| RAF proto-oncogene serine/threonine-protein kinase CHEMBL1906 | IC50 | 5.3 | 5.3 | 5000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 | IC50 | = | 400.0 | nM | 6.4 | In vitro inhibition of mitogen-activated protein kinase p38 alpha 2 derived from... | 11140741 |
| RAF proto-oncogene serine/threonine-protein kinase | IC50 | = | 5000.0 | nM | 5.3 | Inhibition of Raf-1 | 18947905 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11591521 | 10.1016/s0960-894x(01)00571-6 | RAF proto-oncogene serine/threonine-protein kinase | 1 |
| 11140741 | 10.1016/s0960-894x(00)00574-6 | Mitogen-activated protein kinase 14 | 1 |
| 18947905 | 10.1016/j.ejmech.2008.09.016 | RAF proto-oncogene serine/threonine-protein kinase | 1 |
Data from ChEMBL 36 via Core Engine