BDBM50326516 (E)-4-{[1-(2-Fluoroethyl)-1H-[1,2,3]triazol-4-ylmethyl]-amino}-but-2-enoic acid[4-(3-chloro-4-fluoro-phenylamino)-3-cyano-7-ethoxy-quinolin-6-yl]-amide::CHEMBL1243283
SMILES: CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CNCc1cn(CCF)nn1
InChI Key: InChIKey=PLNCBERXTZFKGL-ONEGZZNKSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Epidermal growth factor receptor (Homo sapiens (Human)) | BDBM50326516 ((E)-4-{[1-(2-Fluoroethyl)-1H-[1,2,3]triazol-4-ylme...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 22.0 | n/a | n/a | n/a | n/a | n/a | n/a |
Imperial College London Curated by ChEMBL | Assay Description Inhibition of EGFR autophosphorylation in human A431 cells | Bioorg Med Chem 18: 6634-45 (2010) Article DOI: 10.1016/j.bmc.2010.08.004 BindingDB Entry DOI: 10.7270/Q25H7GG2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Epidermal growth factor receptor (Homo sapiens (Human)) | BDBM50326516 ((E)-4-{[1-(2-Fluoroethyl)-1H-[1,2,3]triazol-4-ylme...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.81 | n/a | n/a | n/a | n/a | n/a | n/a |
Imperial College London Curated by ChEMBL | Assay Description Inhibition of EGFR | Bioorg Med Chem 18: 6634-45 (2010) Article DOI: 10.1016/j.bmc.2010.08.004 BindingDB Entry DOI: 10.7270/Q25H7GG2 | |||||||||||
More data for this Ligand-Target Pair |