Compound Detail
CHEMBL4536595
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Basic Information
| ChEMBL ID | CHEMBL4536595 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SLGWUPRYZVOQMV-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
473.5
MW (Da)
3.84
ALogP
7
HBA
5
HBD
133.1
PSA (Ų)
0.25
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G protein-coupled receptor kinase 5 CHEMBL3879830 | IC50 | 4.0 | 4.0 | 100000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G protein-coupled receptor kinase 5 | IC50 | = | 100000.0 | nM | 4.0 | Inhibition of bovine GRK5 C474S mutant using tubulin as substrate measured after... | 31857838 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31857838 | 10.1021/acsmedchemlett.9b00365 | G protein-coupled receptor kinase 5 | 3 |
| 31857838 | 10.1021/acsmedchemlett.9b00365 | Beta-adrenergic receptor kinase 1 | 1 |
| 31857838 | 10.1021/acsmedchemlett.9b00365 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine