Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50256022'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50256022 (6-(5-((benzylamino)methyl)furan-2-yl)-N-(3-chloro-...) Show SMILES Fc1cccc(COc2ccc(Nc3ncnc4sc(cc34)-c3ccc(CNCc4ccccc4)o3)cc2Cl)c1 Show InChI InChI=1S/C31H24ClFN4O2S/c32-26-14-23(9-11-27(26)38-18-21-7-4-8-22(33)13-21)37-30-25-15-29(40-31(25)36-19-35-30)28-12-10-24(39-28)17-34-16-20-5-2-1-3-6-20/h1-15,19,34H,16-18H2,(H,35,36,37)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of EGFR				Bioorg Med Chem Lett 19: 817-20 (2009) Article DOI: 10.1016/j.bmcl.2008.12.011 BindingDB Entry DOI: 10.7270/Q2TH8NNN
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