Compound Detail
CHEMBL3758926
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Cn1cc(-c2cnc(Nc3cccc(Cn4nc(-c5ccc(C(=O)O)c(F)c5)ccc4=O)c3)nc2)cn1
Basic Information
| ChEMBL ID | CHEMBL3758926 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HRQDDDJWAOLLID-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
497.5
MW (Da)
3.73
ALogP
9
HBA
2
HBD
127.8
PSA (Ų)
0.35
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.98
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 7.98 | 7.98 | 10.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatocyte growth factor receptor | IC50 | = | 10.5 | nM | 7.98 | Inhibition of recombinant c-Met (unknown origin) using poly (Glu,Tyr)4:1 as subs... | 26698536 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26698536 | 10.1016/j.ejmech.2015.11.042 | Hepatocyte growth factor receptor | 1 |
| 26698536 | 10.1016/j.ejmech.2015.11.042 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine