Compound Detail
CHEMBL5398102
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Basic Information
| ChEMBL ID | CHEMBL5398102 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LQNBQZBDXDIOSM-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
471.4
MW (Da)
5.27
ALogP
5
HBA
2
HBD
71.4
PSA (Ų)
0.40
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.32 | 7.32 | 47.7 | 1 |
| MKN-45 CHEMBL614354 | IC50 | 6.17 | 6.17 | 670.0 | 1 |
| EBC-1 CHEMBL4296411 | IC50 | 5.92 | 5.92 | 1194.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 47.7 | nM | 7.32 | Inhibition of c-Met (unknown origin) using Tyr 6 peptide as substrate incubated ... | 37262349 |
| MKN-45 | IC50 | = | 670.0 | nM | 6.17 | Antiproliferative activity against human MKN-45 cells assessed as inhibition of ... | 37262349 |
| EBC-1 | IC50 | = | 1194.0 | nM | 5.92 | Antiproliferative activity against human EBC-1 cells assessed as inhibition of c... | 37262349 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37262349 | 10.1021/acs.jmedchem.3c00028 | Hepatocyte growth factor receptor | 1 |
| 37262349 | 10.1021/acs.jmedchem.3c00028 | MKN-45 | 1 |
| 37262349 | 10.1021/acs.jmedchem.3c00028 | EBC-1 | 1 |
Data from ChEMBL 36 via Core Engine