Compound Detail
CHEMBL2431841
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Basic Information
| ChEMBL ID | CHEMBL2431841 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NSNLFHBIYLDZLA-UHFFFAOYSA-N |
1
Targets
5
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
341.4
MW (Da)
2.66
ALogP
7
HBA
0
HBD
73.8
PSA (Ų)
0.50
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.36
Ki 2 meas. best 8.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | Ki | 8.04 | 7.585 | 9.1 | 2 |
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.36 | 7.0667 | 44.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | Ki | = | 9.1 | nM | 8.04 | In Vitro Assay: A PCR product covering residues 1058-1365 of c-Met (c-Met kinase... | - |
| Hepatocyte growth factor receptor | IC50 | = | 44.0 | nM | 7.36 | Inhibition of c-Met autophosphorylation in human A549 cells after 1 hr by ELISA | 23944843 |
| Hepatocyte growth factor receptor | IC50 | = | 69.0 | nM | 7.16 | Inhibition of c-Met autophosphorylation in human NCI-H441 cells for 1 hr by ELIS... | 25148209 |
| Hepatocyte growth factor receptor | Ki | = | 74.0 | nM | 7.13 | Inhibition of N-terminal His-6-tagged human recombinant c-Met (974 to 1390) usin... | 23944843 |
| Hepatocyte growth factor receptor | IC50 | = | 210.0 | nM | 6.68 | Inhibition of c-Met (unknown origin) using Poly E4Y substrate and ATP incubated ... | 25148209 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23944843 | 10.1021/jm400926x | Hepatocyte growth factor receptor | 2 |
| 25148209 | 10.1021/jm500510f | Hepatocyte growth factor receptor | 2 |
| 23944843 | 10.1021/jm400926x | No relevant target | 1 |
| 23944843 | 10.1021/jm400926x | Liver microsomes | 1 |
Data from ChEMBL 36 via Core Engine