Compile Data Set for Download or QSAR

Found 10 hits Enz. Inhib. hit(s) with Target = 'Hepatocyte growth factor receptor' and Ligand = 'BDBM50532758'   

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
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET in human MKN45 cells assessed as reduction in pMET Y1230/1234/1235 level incubated for 1 hr by ELISA				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET in human MKN45 cells assessed as reduction in pMET Y1230/1234/1235 level incubated for 1 hr by ELISA				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of wild type phosphorylated MET (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptide ad...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of wild type phosphorylated MET (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptide ad...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET M1250T mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET M1250T mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	318	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET L1195V mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	318	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET L1195V mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET Y1230H mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50532758 (CHEMBL4470877) Show SMILES Fc1ccc(cc1)-c1ccc2nnc(Sc3ccc4nc(NC(=O)CCCN5CCOCC5)sc4c3)n2n1 Show InChI InChI=1S/C26H24FN7O2S2/c27-18-5-3-17(4-6-18)20-9-10-23-30-31-26(34(23)32-20)37-19-7-8-21-22(16-19)38-25(28-21)29-24(35)2-1-11-33-12-14-36-15-13-33/h3-10,16H,1-2,11-15H2,(H,28,29,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis Germany GmbH Curated by ChEMBL					Assay Description Inhibition of phosphorylated MET Y1230H mutant (unknown origin) pre-incubated for 30 mins before biotinylated poly(glutamate-alanine-tyrosine) peptid...				J Med Chem 59: 7066-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00280 BindingDB Entry DOI: 10.7270/Q2WM1HW4
					More data for this Ligand-Target Pair