BDBM50177830 2-{[6-Methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino}-5-[(1-phenylprop-2-yn-1-yl)oxy]benzo-1,4-quinone::CHEMBL198862

SMILES: COc1cc2c(N=C3CC(=O)C(OC(C#C)c4ccccc4)=CC3=O)ncnc2cc1OCCCN1CCCC1

InChI Key: InChIKey=WPZOFEMDSHZYFG-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50177830   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50177830 (2-{[6-Methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazol...) Show SMILES COc1cc2c(N=C3CC(=O)C(OC(C#C)c4ccccc4)=CC3=O)ncnc2cc1OCCCN1CCCC1 |w:6.5,c:22| Show InChI InChI=1S/C31H30N4O5/c1-3-27(21-10-5-4-6-11-21)40-28-19-25(36)24(17-26(28)37)34-31-22-16-29(38-2)30(18-23(22)32-20-33-31)39-15-9-14-35-12-7-8-13-35/h1,4-6,10-11,16,18-20,27H,7-9,12-15,17H2,2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP				J Med Chem 48: 7560-81 (2005) Article DOI: 10.1021/jm050559f BindingDB Entry DOI: 10.7270/Q2028R3S
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50177830 (2-{[6-Methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazol...) Show SMILES COc1cc2c(N=C3CC(=O)C(OC(C#C)c4ccccc4)=CC3=O)ncnc2cc1OCCCN1CCCC1 |w:6.5,c:22| Show InChI InChI=1S/C31H30N4O5/c1-3-27(21-10-5-4-6-11-21)40-28-19-25(36)24(17-26(28)37)34-31-22-16-29(38-2)30(18-23(22)32-20-33-31)39-15-9-14-35-12-7-8-13-35/h1,4-6,10-11,16,18-20,27H,7-9,12-15,17H2,2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 1 mm ATP				J Med Chem 48: 7560-81 (2005) Article DOI: 10.1021/jm050559f BindingDB Entry DOI: 10.7270/Q2028R3S
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50177830 (2-{[6-Methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazol...) Show SMILES COc1cc2c(N=C3CC(=O)C(OC(C#C)c4ccccc4)=CC3=O)ncnc2cc1OCCCN1CCCC1 |w:6.5,c:22| Show InChI InChI=1S/C31H30N4O5/c1-3-27(21-10-5-4-6-11-21)40-28-19-25(36)24(17-26(28)37)34-31-22-16-29(38-2)30(18-23(22)32-20-33-31)39-15-9-14-35-12-7-8-13-35/h1,4-6,10-11,16,18-20,27H,7-9,12-15,17H2,2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP and in presence of 5% mouse plasma				J Med Chem 48: 7560-81 (2005) Article DOI: 10.1021/jm050559f BindingDB Entry DOI: 10.7270/Q2028R3S
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50177830 (2-{[6-Methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazol...) Show SMILES COc1cc2c(N=C3CC(=O)C(OC(C#C)c4ccccc4)=CC3=O)ncnc2cc1OCCCN1CCCC1 |w:6.5,c:22| Show InChI InChI=1S/C31H30N4O5/c1-3-27(21-10-5-4-6-11-21)40-28-19-25(36)24(17-26(28)37)34-31-22-16-29(38-2)30(18-23(22)32-20-33-31)39-15-9-14-35-12-7-8-13-35/h1,4-6,10-11,16,18-20,27H,7-9,12-15,17H2,2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP and in presence of 100 uM glutathione				J Med Chem 48: 7560-81 (2005) Article DOI: 10.1021/jm050559f BindingDB Entry DOI: 10.7270/Q2028R3S
					More data for this Ligand-Target Pair