Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50031647'   

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))	BDBM50031647 (1-(4-Benzyloxy-phenyl)-2-piperidin-1-ylmethyl-prop...) Show SMILES C=C(CN1CCCCC1)C(=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C22H25NO2/c1-18(16-23-14-6-3-7-15-23)22(24)20-10-12-21(13-11-20)25-17-19-8-4-2-5-9-19/h2,4-5,8-13H,1,3,6-7,14-17H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
CIBA Limited Curated by ChEMBL					Assay Description In vitro inhibition of the Epidermal growth factor receptor activity in A431 membranes				J Med Chem 38: 2441-8 (1995) BindingDB Entry DOI: 10.7270/Q2MS3TDK
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