Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase' and Ligand = 'BDBM50117664'   

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
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM50117664 (CHEMBL3613708) Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C(C)C)c1 Show InChI InChI=1S/C22H25N5O4S/c1-15(2)27-23-12-21(24-27)25-32(29,30)20-8-7-17-13-26(14-18(17)11-20)22(28)10-16-5-4-6-19(9-16)31-3/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	597	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,...				J Med Chem 58: 7164-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ
					More data for this Ligand-Target Pair
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM50117664 (CHEMBL3613708) Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C(C)C)c1 Show InChI InChI=1S/C22H25N5O4S/c1-15(2)27-23-12-21(24-27)25-32(29,30)20-8-7-17-13-26(14-18(17)11-20)22(28)10-16-5-4-6-19(9-16)31-3/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,24,25)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	631	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,...				J Med Chem 58: 7164-72 (2015) Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ
					More data for this Ligand-Target Pair