Compound Detail
CHEMBL451789
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Basic Information
| ChEMBL ID | CHEMBL451789 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DDPXAYNMHBTSTN-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
459.4
MW (Da)
5.51
ALogP
5
HBA
2
HBD
97.2
PSA (Ų)
0.36
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 5.85 | 5.85 | 1400.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 1400.0 | nM | 5.85 | Inhibition of MET | 18690676 |
| Hepatocyte growth factor receptor | IC50 | = | 1400.0 | nM | 5.85 | Inhibition of human c-MET | 21641696 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18690676 | 10.1021/jm800476q | Hepatocyte growth factor receptor | 1 |
| 18690676 | 10.1021/jm800476q | NON-PROTEIN TARGET | 1 |
| 18690676 | 10.1021/jm800476q | NCI-N87 | 1 |
| 21641696 | 10.1016/j.ejmech.2011.05.031 | Hepatocyte growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine