Compound Detail
CHEMBL518208
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Basic Information
| ChEMBL ID | CHEMBL518208 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BJPFHTCZRZBWRU-UHFFFAOYSA-N |
1
Targets
4
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
498.5
MW (Da)
5.69
ALogP
8
HBA
1
HBD
87.5
PSA (Ų)
0.31
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.2
Ki 2 meas. best 7.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | Ki | 7.85 | 7.525 | 14.0 | 2 |
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.2 | 6.945 | 63.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | Ki | = | 14.0 | nM | 7.85 | Inhibition of recombinant c-met-mediated gastrin phosphorylation by HTRF assay | 22320343 |
| Hepatocyte growth factor receptor | IC50 | = | 63.0 | nM | 7.2 | Inhibition of human c-MET | 21641696 |
| Hepatocyte growth factor receptor | Ki | = | 63.0 | nM | 7.2 | Inhibition of cMet by HTRF assay | 18763753 |
| Hepatocyte growth factor receptor | IC50 | = | 204.0 | nM | 6.69 | Inhibition of HGF-mediated c-met autophosphorylation in serum-starved human PC3 ... | 22320343 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22320343 | 10.1021/jm201330u | Hepatocyte growth factor receptor | 2 |
| 18763753 | 10.1021/jm8006189 | 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