Compound Detail
CHEMBL4780189
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Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCCCC(=O)n2nc(N)c3c(-c4cccc(NC(=O)Nc5cccc(C(C)C)c5)c4)cccc32)C(C)(C)C)cc1
Basic Information
| ChEMBL ID | CHEMBL4780189 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VTPFXZHLKQSXQP-FEDPBZRBSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
1010.3
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 CHEMBL279 | IC50 | 6.68 | 6.68 | 208.2 | 1 |
| EA.hy 926 CHEMBL4296410 | IC50 | 4.48 | 4.48 | 32793.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Vascular endothelial growth factor receptor 2 | IC50 | = | 208.15 | nM | 6.68 | Inhibition of recombinant human N-terminal GST-tagged VEGFR2 (789 to end residue... | 32750566 |
| EA.hy 926 | IC50 | = | 32793.0 | nM | 4.48 | Antiangiogenic activity in human EA.hy 926 cells measured after 24 hrs by MTT as... | 32750566 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32750566 | 10.1016/j.ejmech.2020.112654 | EA.hy 926 | 2 |
| 32750566 | 10.1016/j.ejmech.2020.112654 | Vascular endothelial growth factor receptor 2 | 1 |
| 32750566 | 10.1016/j.ejmech.2020.112654 | HEK293 | 1 |
| 32750566 | 10.1016/j.ejmech.2020.112654 | von Hippel-Lindau disease tumor suppressor/Vascular endothelial growth factor receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine