Compound Detail
CHEMBL3414921
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Basic Information
| ChEMBL ID | CHEMBL3414921 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JBBFCPDEWSTXGG-ZDUSSCGKSA-N |
1
Targets
2
Activities
1
Assay Types
4
PK Parameters
2
Publications
0
Known Names
Molecular Properties
419.5
MW (Da)
5.01
ALogP
7
HBA
0
HBD
65.2
PSA (Ų)
0.41
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 8.05 | 7.855 | 9.0 | 2 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 4404.65 | ng.hr.mL-1 | Rattus norvegicus |
| CL | - | - | Rattus norvegicus |
| F | - | % | Rattus norvegicus |
| T1/2 | 2.8 | hr | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 9.0 | nM | 8.05 | Inhibition of recombinant c-Met kinase domain (unknown origin) incubated for 30 ... | 25699405 |
| Hepatocyte growth factor receptor | IC50 | = | 22.0 | nM | 7.66 | Inhibition of HGF-stimulated c-Met autophosphorylation in serum starved human PC... | 25699405 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25699405 | 10.1021/jm501913a | Rattus norvegicus | 5 |
| 25699405 | 10.1021/jm501913a | Hepatocyte growth factor receptor | 2 |
Data from ChEMBL 36 via Core Engine