Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50383296'   

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))	BDBM50383296 (CHEMBL2029442) Show SMILES COc1cc(ccc1Nc1ncc2CN(C)C(=O)N(c3cccc(N)c3)c2n1)N1CCN(C)CC1 Show InChI InChI=1S/C25H30N8O2/c1-30-9-11-32(12-10-30)19-7-8-21(22(14-19)35-3)28-24-27-15-17-16-31(2)25(34)33(23(17)29-24)20-6-4-5-18(26)13-20/h4-8,13-15H,9-12,16,26H2,1-3H3,(H,27,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of EGFR after 1.5 hr by FRET assay				J Med Chem 55: 2711-23 (2012) Article DOI: 10.1021/jm201591k BindingDB Entry DOI: 10.7270/Q2K938JM
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