Compound Detail
CHEMBL218714
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Basic Information
| ChEMBL ID | CHEMBL218714 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XGJZYPPFLZIHDO-AWEZNQCLSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
375.9
MW (Da)
3.31
ALogP
3
HBA
2
HBD
65.2
PSA (Ų)
0.72
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen phosphorylase, liver form CHEMBL2568 | IC50 | 7.77 | 7.77 | 17.0 | 1 |
| Hepatocyte CHEMBL613362 | IC50 | 5.85 | 5.85 | 1400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen phosphorylase, liver form | IC50 | = | 17.0 | nM | 7.77 | Inhibition of recombinant human liver GPa by multienzyme coupled assay | 16945526 |
| Hepatocyte | IC50 | = | 1400.0 | nM | 5.85 | Inhibition of glucose output in glucagon challenged rat hepatocytes | 16945526 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16945526 | 10.1016/j.bmcl.2006.08.047 | Glycogen phosphorylase, liver form | 1 |
| 16945526 | 10.1016/j.bmcl.2006.08.047 | Hepatocyte | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine