Compound Detail
CHEMBL426990
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL426990 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IGFDTZGDYFGNIJ-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
511.4
MW (Da)
6.73
ALogP
7
HBA
1
HBD
70.4
PSA (Ų)
0.32
QED
2
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src CHEMBL267 | IC50 | 7.47 | 6.695 | 34.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 34.0 | nM | 7.47 | Inhibition of Src protein tyrosine kinase in LANCE format enzyme assay | 15916442 |
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 34.0 | nM | 7.47 | Inhibition of Src kinase | 15615514 |
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 1200.0 | nM | 5.92 | Inhibition of c-Src transformed rat fibroblast proliferation | 15916442 |
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 1200.0 | nM | 5.92 | Inhibition of Src-mediated proliferation of rat 2 fibroblasts | 15615514 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15916442 | 10.1021/jm050175p | Proto-oncogene tyrosine-protein kinase Src | 2 |
| 15615514 | 10.1021/jm049237m | Proto-oncogene tyrosine-protein kinase Src | 2 |
Data from ChEMBL 36 via Core Engine