Compound Detail
CHEMBL2376911
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Basic Information
| ChEMBL ID | CHEMBL2376911 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YYMDLFSNIFIZLY-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
496.5
MW (Da)
6.57
ALogP
6
HBA
2
HBD
77.4
PSA (Ų)
0.25
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mitogen-activated protein kinase 10 CHEMBL2637 | IC50 | 7.34 | 7.34 | 46.0 | 1 |
| Mitogen-activated protein kinase 8 CHEMBL2276 | IC50 | 6.37 | 6.37 | 430.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mitogen-activated protein kinase 10 | IC50 | = | 46.0 | nM | 7.34 | Inhibition of JNK3 (unknown origin)-mediated ATF2 Thr71 phosphorylation by HTRF ... | 23518277 |
| Mitogen-activated protein kinase 8 | IC50 | = | 430.0 | nM | 6.37 | Inhibition of JNK1 (unknown origin)-mediated ATF2 Thr71 phosphorylation by HTRF ... | 23518277 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23518277 | 10.1016/j.bmcl.2013.02.082 | Unchecked | 1 |
| 23518277 | 10.1016/j.bmcl.2013.02.082 | Mitogen-activated protein kinase 8 | 1 |
| 23518277 | 10.1016/j.bmcl.2013.02.082 | Mitogen-activated protein kinase 10 | 1 |
Data from ChEMBL 36 via Core Engine