Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hexokinase-4' and Ligand = 'BDBM50251833'   

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
Hexokinase-4 (Homo sapiens (Human))	BDBM50251833 ((R)-2-(4-(methylsulfonyl)phenyl)-3-(tetrahydro-2H-...) Show SMILES CS(=O)(=O)c1ccc(cc1)[C@@H](CC1CCOCC1)C(=O)Nc1nccs1 |r| Show InChI InChI=1S/C18H22N2O4S2/c1-26(22,23)15-4-2-14(3-5-15)16(12-13-6-9-24-10-7-13)17(21)20-18-19-8-11-25-18/h2-5,8,11,13,16H,6-7,9-10,12H2,1H3,(H,19,20,21)/t16-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	3.47E+3	n/a	n/a	n/a	n/a
Oxford OX4 6LT Curated by ChEMBL					Assay Description Activation of GST fused human liver glucokinase assessed as generation of NADPH by G6PDH coupled assay				J Med Chem 51: 4340-5 (2008) Article DOI: 10.1021/jm8003202 BindingDB Entry DOI: 10.7270/Q2R49QKJ
					More data for this Ligand-Target Pair