Compound Detail
CHEMBL1766539
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Basic Information
| ChEMBL ID | CHEMBL1766539 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BSQKWFYUHAKXEJ-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
432.4
MW (Da)
4.61
ALogP
6
HBA
1
HBD
80.5
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 9.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 9.14 | 9.14 | 0.7 | 1 |
| NIH3T3 CHEMBL614822 | IC50 | 5.85 | 5.85 | 1400.0 | 1 |
| BaF3 CHEMBL614524 | IC50 | 5.38 | 5.38 | 4200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 0.72 | nM | 9.14 | Inhibition of purified recombinant c-Met after 60 mins by ELISA | 21405128 |
| NIH3T3 | IC50 | = | 1400.0 | nM | 5.85 | Antiproliferative activity against mouse NIH/3T3 cells expressing TPR-Met after ... | 21405128 |
| BaF3 | IC50 | = | 4200.0 | nM | 5.38 | Antiproliferative activity against mouse BAF3 cells expressing TPR-Met after 72 ... | 21405128 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21405128 | 10.1021/jm101340q | Hepatocyte growth factor receptor | 3 |
| 21405128 | 10.1021/jm101340q | BaF3 | 2 |
| 21405128 | 10.1021/jm101340q | NIH3T3 | 2 |
Data from ChEMBL 36 via Core Engine