Compound Detail
CHEMBL4161074
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Basic Information
| ChEMBL ID | CHEMBL4161074 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NNUPYMNRYLRFOK-UHFFFAOYSA-N |
| Parent Compound | CHEMBL4302056 |
| Active Moiety | CHEMBL4302056 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
358.5
MW (Da)
3.09
ALogP
6
HBA
3
HBD
80.0
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte CHEMBL3140324 | IC50 | 4.85 | 4.85 | 14200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte | IC50 | = | 14200.0 | nM | 4.85 | Inhibition of glucagon-mediated gluconeogenesis in mouse primary hepatocytes pre... | 29733999 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29733999 | 10.1016/j.ejmech.2018.04.028 | Hepatocyte | 1 |
Data from ChEMBL 36 via Core Engine