Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50245706'   

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))	BDBM50245706 (CHEMBL4072392) Show SMILES CC(=O)c1ccccc1-n1c(nc2cc(Cl)ccc2c1=O)-c1ccccc1 |(31.48,-28.12,;30.56,-29.35,;29.03,-29.16,;31.17,-30.79,;32.48,-30.02,;33.82,-30.78,;33.83,-32.31,;32.51,-33.08,;31.18,-32.31,;29.86,-33.08,;29.87,-34.64,;28.52,-35.42,;27.18,-34.65,;25.84,-35.42,;24.5,-34.65,;23.17,-35.42,;24.5,-33.1,;25.83,-32.33,;27.17,-33.09,;28.51,-32.31,;28.5,-30.76,;31.2,-35.41,;31.2,-36.95,;32.54,-37.72,;33.87,-36.94,;33.86,-35.39,;32.53,-34.63,)| Show InChI InChI=1S/C22H15ClN2O2/c1-14(26)17-9-5-6-10-20(17)25-21(15-7-3-2-4-8-15)24-19-13-16(23)11-12-18(19)22(25)27/h2-13H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
R. C. Patel Institute of Pharmaceutical Education and Research Curated by ChEMBL					Assay Description Inhibition of human EGFR preincubated for 5 mins with substrate followed by ATP addition measured after 30 mins by HTRF method				Bioorg Med Chem 25: 2713-2723 (2017) Article DOI: 10.1016/j.bmc.2017.03.039 BindingDB Entry DOI: 10.7270/Q2NP26TD
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