Compound Detail
CHEMBL212045
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Basic Information
| ChEMBL ID | CHEMBL212045 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ONHADLRFUHGNIQ-PFONDFGASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
353.4
MW (Da)
3.25
ALogP
4
HBA
1
HBD
61.8
PSA (Ų)
0.80
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A CHEMBL4750 | IC50 | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dual specificity tyrosine-phosphorylation-regulated kinase 1A | IC50 | = | 50000.0 | nM | 4.3 | Inhibition of mouse Dyrk1A autophosphorylation in HEk293 cells | 16698266 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16698266 | 10.1016/j.bmcl.2006.04.042 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A | 2 |
Data from ChEMBL 36 via Core Engine