Compound Detail
CHEMBL243518
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Basic Information
| ChEMBL ID | CHEMBL243518 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BQWUBCRDJPIJAT-UHFFFAOYSA-N |
11
Targets
11
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
338.3
MW (Da)
4.11
ALogP
5
HBA
3
HBD
87.1
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 10 meas. best 8.5
IC50 1 meas. best 7.03
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | Ki | 8.5 | 8.5 | 3.2 | 1 |
| Aurora kinase B CHEMBL2185 | Ki | 8.3 | 8.3 | 5.0 | 1 |
| Homeodomain-interacting protein kinase 2 CHEMBL4576 | Ki | 8.2 | 8.2 | 6.3 | 1 |
| Aurora kinase A CHEMBL4722 | Ki | 7.8 | 7.8 | 15.8 | 1 |
| Dual specificity protein kinase CLK4 CHEMBL4203 | Ki | 7.1 | 7.1 | 79.4 | 1 |
| Mitogen-activated protein kinase 8 CHEMBL2276 | IC50 | 7.03 | 7.03 | 93.0 | 1 |
| Serine/threonine-protein kinase pim-1 CHEMBL2147 | Ki | 6.8 | 6.8 | 158.5 | 1 |
| Mitogen-activated protein kinase kinase kinase kinase 4 CHEMBL6166 | Ki | 6.7 | 6.7 | 199.5 | 1 |
| MAP kinase-interacting serine/threonine-protein kinase 2 CHEMBL4204 | Ki | 6.6 | 6.6 | 251.2 | 1 |
| Cyclin-dependent kinase 2 CHEMBL301 | Ki | 6.4 | 6.4 | 398.1 | 1 |
| Interleukin-1 receptor-associated kinase 4 CHEMBL3778 | Ki | 5.4 | 5.4 | 3981.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17107797 | 10.1016/j.bmcl.2006.10.093 | Mitogen-activated protein kinase 8 | 1 |
Data from ChEMBL 36 via Core Engine