Compound Detail
CHEMBL3746157
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 | CHEMBL3746157 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YTNDIPNEFMPJKF-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
244.3
MW (Da)
1.56
ALogP
5
HBA
1
HBD
73.3
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity mitogen-activated protein kinase kinase 3 CHEMBL2109 | IC50 | 8.4 | 8.4 | 4.0 | 1 |
| Mitogen-activated protein kinase 14 CHEMBL260 | IC50 | 6.43 | 6.43 | 370.0 | 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 | = | 4.0 | nM | 8.4 | Inhibition of MKK3 (unknown origin) using [gamma-33P]-ATP after 20 mins by radio... | 26704264 |
| Mitogen-activated protein kinase 14 | IC50 | = | 370.0 | nM | 6.43 | Inhibition of p38alpha phosphorylation in human TNFalpha-stimulated U937 cells t... | 26704264 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26704264 | 10.1016/j.bmcl.2015.11.054 | Unchecked | 12 |
| 26704264 | 10.1016/j.bmcl.2015.11.054 | Dual specificity mitogen-activated protein kinase kinase 3 | 1 |
| 26704264 | 10.1016/j.bmcl.2015.11.054 | Mitogen-activated protein kinase 14 | 1 |
Data from ChEMBL 36 via Core Engine