Compound Detail
CHEMBL210861
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 | CHEMBL210861 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MPULMLDKNWNYOT-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
296.3
MW (Da)
2.12
ALogP
5
HBA
2
HBD
101.0
PSA (Ų)
0.88
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 8 CHEMBL2276 | IC50 | 6.58 | 6.41 | 260.0 | 2 |
| Mitogen-activated protein kinase 9 CHEMBL4179 | IC50 | 6.11 | 6.11 | 770.0 | 1 |
| Small ribosomal subunit protein eS27 CHEMBL1932893 | IC50 | 5.38 | 5.38 | 4200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 8 | IC50 | = | 260.0 | nM | 6.58 | Inhibition of JNK1-mediated ATF2 phosphorylation after 1 hr by ELISA | 24900510 |
| Mitogen-activated protein kinase 8 | IC50 | = | 570.0 | nM | 6.24 | Inhibition of JNK1-mediated ATF2 phosphorylation | 16759099 |
| Mitogen-activated protein kinase 9 | IC50 | = | 770.0 | nM | 6.11 | Inhibition of JNK2-mediated ATF2 phosphorylation | 16759099 |
| Small ribosomal subunit protein eS27 | IC50 | = | 4200.0 | nM | 5.38 | Inhibition of Mps1-mediated p38 MAPK phosphorylation after 90 mins by DELFIA ass... | 24900510 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16759099 | 10.1021/jm060199b | Mitogen-activated protein kinase 8 | 1 |
| 16759099 | 10.1021/jm060199b | Mitogen-activated protein kinase 9 | 1 |
| 24900510 | 10.1021/ml3000879 | Small ribosomal subunit protein eS27 | 1 |
| 24900510 | 10.1021/ml3000879 | Mitogen-activated protein kinase 8 | 1 |
Data from ChEMBL 36 via Core Engine