Compound Detail
CHEMBL462171
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Basic Information
| ChEMBL ID | CHEMBL462171 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PSJWZNOEQQDVFH-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
451.5
MW (Da)
3.18
ALogP
7
HBA
2
HBD
114.9
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.19
Ki 1 meas. best 5.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 5.19 | 5.19 | 6400.0 | 1 |
| Hepatocyte growth factor receptor CHEMBL3717 | Ki | 5.19 | 5.19 | 6400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 6400.0 | nM | 5.19 | Inhibition of human c-MET | 21641696 |
| Hepatocyte growth factor receptor | Ki | = | 6400.0 | nM | 5.19 | Inhibition of human activated c-Met by PK/LDH coupled kinetic assay | 17964000 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17964000 | 10.1016/j.ejmech.2007.08.011 | Hepatocyte growth factor receptor | 1 |
| 21641696 | 10.1016/j.ejmech.2011.05.031 | Hepatocyte growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine