Compound Detail
CHEMBL462622
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Basic Information
| ChEMBL ID | CHEMBL462622 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BWAXVHRXKFQTBX-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
458.4
MW (Da)
4.12
ALogP
6
HBA
2
HBD
99.2
PSA (Ų)
0.44
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 9.0 | 9.0 | 1.0 | 2 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 7.51 | 7.51 | 31.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 1.0 | nM | 9.0 | Inhibition of MET | 19260711 |
| Hepatocyte growth factor receptor | IC50 | = | 1.0 | nM | 9.0 | Inhibition of human c-MET | 21641696 |
| NON-PROTEIN TARGET | IC50 | = | 31.0 | nM | 7.51 | Antiproliferative activity against Met-dependent human GTL16 cells after 72 hrs ... | 19260711 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19260711 | 10.1021/jm801586s | Hepatocyte growth factor receptor | 1 |
| 19260711 | 10.1021/jm801586s | NON-PROTEIN TARGET | 1 |
| 19260711 | 10.1021/jm801586s | Cytochrome P450 3A4 | 1 |
| 21641696 | 10.1016/j.ejmech.2011.05.031 | Hepatocyte growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine