Compound Detail
CHEMBL1825134
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Basic Information
| ChEMBL ID | CHEMBL1825134 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NUGLKXMTNVCMMF-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
422.3
MW (Da)
4.26
ALogP
6
HBA
2
HBD
78.0
PSA (Ų)
0.60
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.23
Ki 1 meas. best 7.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | Ki | 7.45 | 7.45 | 35.2 | 1 |
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.23 | 7.23 | 58.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | Ki | = | 35.2 | nM | 7.45 | Binding affinity to human recombinant c-MET assessed as inhibition of autophosph... | 21812414 |
| Hepatocyte growth factor receptor | IC50 | = | 58.7 | nM | 7.23 | Inhibition of human recombinant c-MET kinase expressed in A549 cells assessed as... | 21812414 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21812414 | 10.1021/jm2007613 | Hepatocyte growth factor receptor | 2 |
| 21812414 | 10.1021/jm2007613 | Liver microsomes | 1 |
Data from ChEMBL 36 via Core Engine