Compound Detail
CHEMBL361886
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Basic Information
| ChEMBL ID | CHEMBL361886 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FYWYYGLUFUROPO-UHFFFAOYSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
516.7
MW (Da)
3.40
ALogP
8
HBA
2
HBD
62.8
PSA (Ų)
0.38
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 5.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src CHEMBL3655 | IC50 | 5.17 | 5.17 | 6800.0 | 1 |
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 5.06 | 5.06 | 8700.0 | 1 |
| Fibroblast growth factor receptor 1 CHEMBL3650 | IC50 | 4.92 | 4.78 | 12000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Proto-oncogene tyrosine-protein kinase Src | IC50 | = | 6800.0 | nM | 5.17 | Inhibition of glutamate/tyrosine (4:1) copolymer phosphorylation by avian c-Src ... | 16000000 |
| Vascular endothelial growth factor receptor 2 | IC50 | = | 8700.0 | nM | 5.06 | Inhibition of glutamate/tyrosine (4:1) copolymer phosphorylation by human VEGFR ... | 16000000 |
| Fibroblast growth factor receptor 1 | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of glutamate/tyrosine (4:1) copolymer phosphorylation by human fibrob... | 16000000 |
| Fibroblast growth factor receptor 1 | IC50 | = | 23000.0 | nM | 4.64 | Inhibition of glutamate/tyrosine (4:1) copolymer phosphorylation by human FGFR1 ... | 16000000 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16000000 | 10.1021/jm0500931 | Fibroblast growth factor receptor 1 | 2 |
| 16000000 | 10.1021/jm0500931 | Vascular endothelial growth factor receptor 2 | 1 |
| 16000000 | 10.1021/jm0500931 | Platelet-derived growth factor receptor beta | 1 |
| 16000000 | 10.1021/jm0500931 | Proto-oncogene tyrosine-protein kinase Src | 1 |
Data from ChEMBL 36 via Core Engine