Compound Detail
CHEMBL1796186
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Basic Information
| ChEMBL ID | CHEMBL1796186 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QNAUNBUSBVIRTD-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
389.4
MW (Da)
2.17
ALogP
6
HBA
3
HBD
130.0
PSA (Ų)
0.28
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.92
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor CHEMBL1957 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
| Proto-oncogene tyrosine-protein kinase Src CHEMBL267 | IC50 | 4.66 | 4.66 | 22000.0 | 1 |
| Hepatocyte growth factor receptor CHEMBL3717 | IC50 | 4.02 | 4.02 | 95000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Insulin-like growth factor 1 receptor | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of IGF-1R assessed as incorporation of p33 using [gammaP33]-ATP by mi... | 21524503 |
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 22000.0 | nM | 4.66 | Inhibition of SRC assessed as incorporation of p33 using [gammaP33]-ATP by micro... | 21524503 |
| Hepatocyte growth factor receptor | IC50 | = | 95000.0 | nM | 4.02 | Inhibition of c-MET assessed as incorporation of p33 using [gammaP33]-ATP by mic... | 21524503 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Hepatocyte growth factor receptor | 1 |
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Insulin-like growth factor 1 receptor | 1 |
| 21524503 | 10.1016/j.ejmech.2011.03.065 | Proto-oncogene tyrosine-protein kinase Src | 1 |
Data from ChEMBL 36 via Core Engine