Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor [T790M,L858R]' and Ligand = 'BDBM318872'   

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 [T790M,L858R] (Homo sapiens (Human))	BDBM318872 (N-(3-(2-((6-(4-methylpiperazin-1-yl)pyridin-3-yl)a...) Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3cccc(-c4cccc(NC(=O)C=C)c4)c3n2)cn1 Show InChI InChI=1S/C27H27N7O/c1-3-25(35)30-21-8-4-6-19(16-21)23-9-5-7-20-17-29-27(32-26(20)23)31-22-10-11-24(28-18-22)34-14-12-33(2)13-15-34/h3-11,16-18H,1,12-15H2,2H3,(H,30,35)(H,29,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
NEUPHARMA, INC. US Patent					Assay Description The compound of Formula I binds to a kinase selected from the group consisting of EGFR, EGFR L858R, EGFR T790M, EGFR del E746-A750, or EGFR L858R/T79...				US Patent US10172868 (2019) BindingDB Entry DOI: 10.7270/Q25141BX
					More data for this Ligand-Target Pair
Epidermal growth factor receptor [T790M,L858R] (Homo sapiens (Human))	BDBM318872 (N-(3-(2-((6-(4-methylpiperazin-1-yl)pyridin-3-yl)a...) Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3cccc(-c4cccc(NC(=O)C=C)c4)c3n2)cn1 Show InChI InChI=1S/C27H27N7O/c1-3-25(35)30-21-8-4-6-19(16-21)23-9-5-7-20-17-29-27(32-26(20)23)31-22-10-11-24(28-18-22)34-14-12-33(2)13-15-34/h3-11,16-18H,1,12-15H2,2H3,(H,30,35)(H,29,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description EGFR (T790M)(L858R):The 2×EGFR (ErbB1) T790M L858R/Tyr 04 mixture is prepared in 50 mM HEPES pH 6.5, 0.01% BRIJ-35, 10 mM MgCl2, 1 mM EGTA, 0.02% NaN...				Citation and Details BindingDB Entry DOI: 10.7270/Q2571G7W
					More data for this Ligand-Target Pair
Epidermal growth factor receptor [T790M,L858R] (Homo sapiens (Human))	BDBM318872 (N-(3-(2-((6-(4-methylpiperazin-1-yl)pyridin-3-yl)a...) Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3cccc(-c4cccc(NC(=O)C=C)c4)c3n2)cn1 Show InChI InChI=1S/C27H27N7O/c1-3-25(35)30-21-8-4-6-19(16-21)23-9-5-7-20-17-29-27(32-26(20)23)31-22-10-11-24(28-18-22)34-14-12-33(2)13-15-34/h3-11,16-18H,1,12-15H2,2H3,(H,30,35)(H,29,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
NEUPHARMA, INC. US Patent					Assay Description (i) Peptide/Kinase Mixtures for measurement of EGFR (ErbB1):The 2×EGFR (ErbB1)/Tyr 04 mixture is prepared in 50 mM HEPES pH 7.5, 0.01% BRIJ-35, 10 mM...				US Patent US10653701 (2020) BindingDB Entry DOI: 10.7270/Q2TB19XQ
					More data for this Ligand-Target Pair