Compound Detail
CHEMBL2159845
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Basic Information
| ChEMBL ID | CHEMBL2159845 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MAZQOFWUNXOPKQ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
241.3
MW (Da)
1.71
ALogP
5
HBA
2
HBD
78.9
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G protein-coupled receptor kinase 6 CHEMBL6144 | IC50 | 5.34 | 5.34 | 4600.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G protein-coupled receptor kinase 6 | IC50 | = | 4600.0 | nM | 5.34 | Inhibition of human recombinant full-length GST-tagged human GRK6 using peptide ... | - |
| G protein-coupled receptor kinase 6 | IC50 | = | 4600.0 | nM | 5.34 | TBD: TBD | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23044371 | 10.1016/j.bmcl.2012.09.037 | Sentrin-specific protease 1 | 1 |
Data from ChEMBL 36 via Core Engine