Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM192317'   

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))	BDBM192317 (US9187459, 2) Show SMILES CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCC1C2COCC12 Show InChI InChI=1S/C26H27ClFN5O3/c1-33(2)7-3-4-25(34)32-23-9-16-22(10-24(23)36-13-19-17-11-35-12-18(17)19)29-14-30-26(16)31-15-5-6-21(28)20(27)8-15/h3-6,8-10,14,17-19H,7,11-13H2,1-2H3,(H,32,34)(H,29,30,31)/b4-3+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.130	n/a	n/a	n/a	n/a	n/a	25
NewGen Therapeutics, Inc. US Patent					Assay Description 1) The compound is dissolved in DMSO to prepare a 10 mM solution, and was diluted to 100 micoM with water. When used for IC50 measurement, series dil...				US Patent US9187459 (2015) BindingDB Entry DOI: 10.7270/Q25719TF
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