Compound Detail
CHEMBL526929
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL526929 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NDRBDNKFYLWQEU-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
451.4
MW (Da)
2.94
ALogP
6
HBA
4
HBD
132.4
PSA (Ų)
0.44
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 8.3 | 8.3 | 5.0 | 2 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 6.6 | 6.6 | 250.0 | 1 |
| Cytochrome P450 3A4 CHEMBL340 | IC50 | 5.75 | 5.75 | 1800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 5.0 | nM | 8.3 | Inhibition of Met kinase | 18479916 |
| Hepatocyte growth factor receptor | IC50 | = | 5.0 | nM | 8.3 | Inhibition of human c-MET | 21641696 |
| NON-PROTEIN TARGET | IC50 | = | 250.0 | nM | 6.6 | Antiproliferative activity against human GTL16 cells | 18479916 |
| Cytochrome P450 3A4 | IC50 | = | 1800.0 | nM | 5.75 | Inhibition of human CYP3A4 | 18479916 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18479916 | 10.1016/j.bmcl.2008.04.047 | Hepatocyte growth factor receptor | 1 |
| 18479916 | 10.1016/j.bmcl.2008.04.047 | NON-PROTEIN TARGET | 1 |
| 18479916 | 10.1016/j.bmcl.2008.04.047 | Cytochrome P450 3A4 | 1 |
| 21641696 | 10.1016/j.ejmech.2011.05.031 | Hepatocyte growth factor receptor | 1 |
Data from ChEMBL 36 via Core Engine