Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-galactoside alpha-2,6-sialyltransferase 1' and Ligand = 'BDBM50127709'   

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-galactoside alpha-2,6-sialyltransferase 1 (Homo sapiens (Human))	BDBM50127709 (CHEMBL3629689) Show SMILES [Na+].[Na+].[Na+].Nc1ccn([C@@H]2O[C@H](COP([O-])(=O)OC(C3CCCC3)P([O-])([O-])=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C15H25N3O11P2.3Na/c16-10-5-6-18(15(21)17-10)13-12(20)11(19)9(28-13)7-27-31(25,26)29-14(30(22,23)24)8-3-1-2-4-8;;;/h5-6,8-9,11-14,19-20H,1-4,7H2,(H,25,26)(H2,16,17,21)(H2,22,23,24);;;/q;3*+1/p-3/t9-,11-,12-,13-,14?;;;/m1.../s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of recombinant human N-terminal His-tagged ST6Gal-1 (44 to 406 residues) using CMP-Neu5Ac as substrate after 20 mins by UV/RP-HPLC method				J Med Chem 60: 2135-2141 (2017) Article DOI: 10.1021/acs.jmedchem.6b01644 BindingDB Entry DOI: 10.7270/Q2XP77Z0
					More data for this Ligand-Target Pair
Beta-galactoside alpha-2,6-sialyltransferase 1 (Homo sapiens (Human))	BDBM50127709 (CHEMBL3629689) Show SMILES [Na+].[Na+].[Na+].Nc1ccn([C@@H]2O[C@H](COP([O-])(=O)OC(C3CCCC3)P([O-])([O-])=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C15H25N3O11P2.3Na/c16-10-5-6-18(15(21)17-10)13-12(20)11(19)9(28-13)7-27-31(25,26)29-14(30(22,23)24)8-3-1-2-4-8;;;/h5-6,8-9,11-14,19-20H,1-4,7H2,(H,25,26)(H2,16,17,21)(H2,22,23,24);;;/q;3*+1/p-3/t9-,11-,12-,13-,14?;;;/m1.../s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Competitive inhibition of human recombinant ST6Gal-1 using CMP-Neu5Ac and p-nitrophenyl LacNAc as donar and acceptor by Lineweaver-Burk double recipr...				J Med Chem 58: 7972-90 (2015) Article DOI: 10.1021/acs.jmedchem.5b01181 BindingDB Entry DOI: 10.7270/Q20V8FMQ
					More data for this Ligand-Target Pair