BDBM50119071 4-(3-Chloro-4-fluoro-phenylamino)-7-methoxy-6-(3-morpholin-4-yl-propoxy)-quinoline-3-carbonitrile::CHEMBL99024

SMILES: COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1

InChI Key: InChIKey=OPYYYPKXOUKXEH-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50119071   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50119071 (4-(3-Chloro-4-fluoro-phenylamino)-7-methoxy-6-(3-m...) Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 Show InChI InChI=1S/C24H24ClFN4O3/c1-31-22-13-21-18(12-23(22)33-8-2-5-30-6-9-32-10-7-30)24(16(14-27)15-28-21)29-17-3-4-20(26)19(25)11-17/h3-4,11-13,15H,2,5-10H2,1H3,(H,28,29)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human epidermal growth factor receptor-2 autophosphorylation				Bioorg Med Chem Lett 12: 2893-7 (2002) BindingDB Entry DOI: 10.7270/Q23J3DHW
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50119071 (4-(3-Chloro-4-fluoro-phenylamino)-7-methoxy-6-(3-m...) Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 Show InChI InChI=1S/C24H24ClFN4O3/c1-31-22-13-21-18(12-23(22)33-8-2-5-30-6-9-32-10-7-30)24(16(14-27)15-28-21)29-17-3-4-20(26)19(25)11-17/h3-4,11-13,15H,2,5-10H2,1H3,(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of Epidermal Growth Factor Receptor (EGFR) autophosphorylation				Bioorg Med Chem Lett 12: 2893-7 (2002) BindingDB Entry DOI: 10.7270/Q23J3DHW
					More data for this Ligand-Target Pair