Compound Detail
CHEMBL5275126
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Basic Information
| ChEMBL ID | CHEMBL5275126 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JRWCBEOAFGHNNU-BNEYPBHNSA-N |
| Parent Compound | CHEMBL2133806 |
| Active Moiety | CHEMBL2133806 |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
377.4
MW (Da)
3.21
ALogP
7
HBA
0
HBD
73.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 8.59 | 8.59 | 2.6 | 2 |
| EBC-1 CHEMBL4296411 | IC50 | 7.77 | 7.77 | 17.0 | 1 |
| MKN-45 CHEMBL614354 | IC50 | 7.6 | 7.6 | 25.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 2.6 | nM | 8.59 | Inhibition of c-Met (unknown origin) | 34655985 |
| Hepatocyte growth factor receptor | IC50 | = | 2.6 | nM | 8.59 | Inhibition of MET (unknown origin) | 37262349 |
| EBC-1 | IC50 | = | 17.0 | nM | 7.77 | Antiproliferative activity against human EBC-1 cells assessed as inhibition of c... | 37262349 |
| MKN-45 | IC50 | = | 25.0 | nM | 7.6 | Antiproliferative activity against human MKN-45 cells assessed as inhibition of ... | 37262349 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34655985 | 10.1016/j.ejmech.2021.113865 | Hepatocyte growth factor receptor | 1 |
| 37262349 | 10.1021/acs.jmedchem.3c00028 | Hepatocyte growth factor receptor | 1 |
| 37262349 | 10.1021/acs.jmedchem.3c00028 | EBC-1 | 1 |
| 37262349 | 10.1021/acs.jmedchem.3c00028 | MKN-45 | 1 |
Data from ChEMBL 36 via Core Engine