Compound Detail
CHEMBL3747443
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Basic Information
| ChEMBL ID | CHEMBL3747443 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WJYRUYCPJGTZBM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
214.2
MW (Da)
0.82
ALogP
4
HBA
2
HBD
94.9
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity mitogen-activated protein kinase kinase 3 CHEMBL2109 | IC50 | 7.52 | 7.52 | 30.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dual specificity mitogen-activated protein kinase kinase 3 | IC50 | = | 30.0 | nM | 7.52 | Inhibition of MKK3 (unknown origin) using [gamma-33P]-ATP after 20 mins by radio... | 26704264 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26704264 | 10.1016/j.bmcl.2015.11.054 | Dual specificity mitogen-activated protein kinase kinase 3 | 1 |
Data from ChEMBL 36 via Core Engine