Compound Detail
CHEMBL5180549
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Basic Information
| ChEMBL ID | CHEMBL5180549 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CILGVAIRQUNMLT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
195.2
MW (Da)
2.62
ALogP
2
HBA
1
HBD
41.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.95
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dual specificity protein kinase CLK1 CHEMBL4224 | IC50 | 6.95 | 6.95 | 112.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dual specificity protein kinase CLK1 | IC50 | = | 112.6 | nM | 6.95 | Inhibition of human CLK1 | 34519506 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35863237 | 10.1016/j.bmc.2022.116921 | Dual specificity tyrosine-phosphorylation-regulated kinase 1A | 1 |
| 35863237 | 10.1016/j.bmc.2022.116921 | Dual specificity protein kinase CLK1 | 1 |
| 34519506 | 10.1021/acs.jmedchem.1c00985 | Dual specificity protein kinase CLK2 | 1 |
| 34519506 | 10.1021/acs.jmedchem.1c00985 | Dual specificity protein kinase CLK1 | 1 |
Data from ChEMBL 36 via Core Engine