Compound Detail
CHEMBL5435855
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 | CHEMBL5435855 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XQDQSKBDKYTWPW-QVYJARAXSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
342.4
MW (Da)
2.31
ALogP
6
HBA
2
HBD
88.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity protein kinase CLK4 CHEMBL4203 | IC50 | 8.27 | 8.27 | 5.4 | 1 |
| Dual specificity protein kinase CLK1 CHEMBL4224 | IC50 | 7.85 | 7.85 | 14.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dual specificity protein kinase CLK4 | IC50 | = | 5.4 | nM | 8.27 | Inhibition of human CLK4 assessed as incorporation of 33Pi using [gamma-33P]-ATP... | 38051674 |
| Dual specificity protein kinase CLK1 | IC50 | = | 14.2 | nM | 7.85 | Inhibition of human CLK1 assessed as incorporation of 33Pi using [gamma-33P]-ATP... | 38051674 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38051674 | 10.1021/acs.jmedchem.3c01888 | Dual specificity protein kinase CLK1 | 1 |
| 38051674 | 10.1021/acs.jmedchem.3c01888 | Dual specificity protein kinase CLK4 | 1 |
Data from ChEMBL 36 via Core Engine