Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM81726'   

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))	BDBM81726 (Bis-quinazolinotriazene, 5a) Show SMILES CN(CCN(CCN(C)\N=N\c1ccc2ncnc(Nc3cccc(C)c3)c2c1)CCN1CCOCC1)\N=N\c1ccc2ncnc(Nc3cccc(C)c3)c2c1 Show InChI InChI=1S/C42H50N14O/c1-31-7-5-9-33(25-31)47-41-37-27-35(11-13-39(37)43-29-45-41)49-51-53(3)15-17-55(19-20-56-21-23-57-24-22-56)18-16-54(4)52-50-36-12-14-40-38(28-36)42(46-30-44-40)48-34-10-6-8-32(2)26-34/h5-14,25-30H,15-24H2,1-4H3,(H,43,45,47)(H,44,46,48)/b51-49+,52-50+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	37
McGill University/Royal Victoria Hospital					Assay Description EGFR kinase assay was perform using Nunc MaxiSorp purchased from Nalge Nunc Interantional.				Chem Biol Drug Des 71: 374-9 (2008) Article DOI: 10.1111/j.1747-0285.2008.00638.x BindingDB Entry DOI: 10.7270/Q29P303S
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