Compound Detail
CHEMBL2182084
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Basic Information
| ChEMBL ID | CHEMBL2182084 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IORNNUKBDFQQEZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
394.5
MW (Da)
5.79
ALogP
4
HBA
2
HBD
58.2
PSA (Ų)
0.55
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 7.77 | 7.77 | 17.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 14 | IC50 | = | 17.0 | nM | 7.77 | Inhibition of MAP kinase p38alpha assessed as phosphorylation of ATF-2 | 22897496 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22897496 | 10.1021/jm300951u | Mitogen-activated protein kinase 14 | 1 |
Data from ChEMBL 36 via Core Engine