Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50177858'   

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))	BDBM50177858 (CHEMBL3814859) Show SMILES CN1CCC(CC1)n1cc(cn1)-c1cnc(N)c(n1)-c1nc2ccccc2n1-c1ccc(NC(=O)C=C)cc1 Show InChI InChI=1S/C29H29N9O/c1-3-26(39)33-20-8-10-22(11-9-20)38-25-7-5-4-6-23(25)35-29(38)27-28(30)31-17-24(34-27)19-16-32-37(18-19)21-12-14-36(2)15-13-21/h3-11,16-18,21H,1,12-15H2,2H3,(H2,30,31)(H,33,39)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.38E+3	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibitory activity towards acetylcholine esterase (AChE)				ACS Med Chem Lett 7: 514-9 (2016) Article DOI: 10.1021/acsmedchemlett.6b00058 BindingDB Entry DOI: 10.7270/Q2474CSN
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50177858 (CHEMBL3814859) Show SMILES CN1CCC(CC1)n1cc(cn1)-c1cnc(N)c(n1)-c1nc2ccccc2n1-c1ccc(NC(=O)C=C)cc1 Show InChI InChI=1S/C29H29N9O/c1-3-26(39)33-20-8-10-22(11-9-20)38-25-7-5-4-6-23(25)35-29(38)27-28(30)31-17-24(34-27)19-16-32-37(18-19)21-12-14-36(2)15-13-21/h3-11,16-18,21H,1,12-15H2,2H3,(H2,30,31)(H,33,39)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of EGFR T790M/L858R double mutant autophosphorylation in human NCI-H1975 cells incubated for 2 hrs by ELISA				ACS Med Chem Lett 7: 514-9 (2016) Article DOI: 10.1021/acsmedchemlett.6b00058 BindingDB Entry DOI: 10.7270/Q2474CSN
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50177858 (CHEMBL3814859) Show SMILES CN1CCC(CC1)n1cc(cn1)-c1cnc(N)c(n1)-c1nc2ccccc2n1-c1ccc(NC(=O)C=C)cc1 Show InChI InChI=1S/C29H29N9O/c1-3-26(39)33-20-8-10-22(11-9-20)38-25-7-5-4-6-23(25)35-29(38)27-28(30)31-17-24(34-27)19-16-32-37(18-19)21-12-14-36(2)15-13-21/h3-11,16-18,21H,1,12-15H2,2H3,(H2,30,31)(H,33,39)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	120	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of EGFR exon19 deletion activating mutant autophosphorylation in human PC9 cells incubated for 2 hrs by ELISA				ACS Med Chem Lett 7: 514-9 (2016) Article DOI: 10.1021/acsmedchemlett.6b00058 BindingDB Entry DOI: 10.7270/Q2474CSN
					More data for this Ligand-Target Pair