Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50011154   

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))	BDBM2579 ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...) Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of cMET (unknown origin) using FAM-labeled peptide as substrate pre-incubated for 5 to 10 mins followed by substrate addition and measured...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127076 BindingDB Entry DOI: 10.7270/Q2Z3237G
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50545333 (CHEMBL4632661) Show SMILES Cc1cc(=O)n(nc1C(=O)Nc1ccc(Oc2ccnc(c2)C(=O)NCCCN2CCOCC2)cc1)-c1ccccc1OC(F)(F)F Show InChI InChI=1S/C32H31F3N6O6/c1-21-19-28(42)41(26-5-2-3-6-27(26)47-32(33,34)35)39-29(21)31(44)38-22-7-9-23(10-8-22)46-24-11-13-36-25(20-24)30(43)37-12-4-14-40-15-17-45-18-16-40/h2-3,5-11,13,19-20H,4,12,14-18H2,1H3,(H,37,43)(H,38,44)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	807	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of cMET (unknown origin) using FAM-labeled peptide as substrate pre-incubated for 5 to 10 mins followed by substrate addition and measured...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127076 BindingDB Entry DOI: 10.7270/Q2Z3237G
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50545331 (CHEMBL4646949) Show SMILES Cc1ccc(cc1)-n1nc(C(=O)Nc2ccc(Oc3ccnc(c3)C(=O)NCCCN3CCOCC3)cc2)c(C)cc1=O Show InChI InChI=1S/C32H34N6O5/c1-22-4-8-25(9-5-22)38-29(39)20-23(2)30(36-38)32(41)35-24-6-10-26(11-7-24)43-27-12-14-33-28(21-27)31(40)34-13-3-15-37-16-18-42-19-17-37/h4-12,14,20-21H,3,13,15-19H2,1-2H3,(H,34,40)(H,35,41)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of cMET (unknown origin) using FAM-labeled peptide as substrate pre-incubated for 5 to 10 mins followed by substrate addition and measured...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127076 BindingDB Entry DOI: 10.7270/Q2Z3237G
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50545334 (CHEMBL4642495) Show SMILES Cc1cc(=O)n(nc1C(=O)Nc1ccc(Oc2ccnc(c2)C(=O)NCCCN2CCOCC2)cc1)-c1ccc(Br)cc1F Show InChI InChI=1S/C31H30BrFN6O5/c1-20-17-28(40)39(27-8-3-21(32)18-25(27)33)37-29(20)31(42)36-22-4-6-23(7-5-22)44-24-9-11-34-26(19-24)30(41)35-10-2-12-38-13-15-43-16-14-38/h3-9,11,17-19H,2,10,12-16H2,1H3,(H,35,41)(H,36,42)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of cMET (unknown origin) using FAM-labeled peptide as substrate pre-incubated for 5 to 10 mins followed by substrate addition and measured...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127076 BindingDB Entry DOI: 10.7270/Q2Z3237G
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50545332 (CHEMBL4645683) Show SMILES Cc1cc(=O)n(nc1C(=O)Nc1ccc(Oc2ccnc(c2)C(=O)NCCCN2CCOCC2)cc1)-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C32H31F3N6O5/c1-21-18-28(42)41(24-5-2-4-22(19-24)32(33,34)35)39-29(21)31(44)38-23-6-8-25(9-7-23)46-26-10-12-36-27(20-26)30(43)37-11-3-13-40-14-16-45-17-15-40/h2,4-10,12,18-20H,3,11,13-17H2,1H3,(H,37,43)(H,38,44)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science & Technology Normal University Curated by ChEMBL					Assay Description Inhibition of cMET (unknown origin) using FAM-labeled peptide as substrate pre-incubated for 5 to 10 mins followed by substrate addition and measured...				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127076 BindingDB Entry DOI: 10.7270/Q2Z3237G
					More data for this Ligand-Target Pair