Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50475558'   

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
Histone deacetylase (Rattus norvegicus)	BDBM50475558 (6-(4-Dimethylaminophenylsulfinyl)Hexanoic Acid Hyd...) Show SMILES CN(C)c1ccc(cc1)[S+]([O-])CCCCCC(=O)NO Show InChI InChI=1S/C14H22N2O3S/c1-16(2)12-7-9-13(10-8-12)20(19)11-5-3-4-6-14(17)15-18/h7-10,18H,3-6,11H2,1-2H3,(H,15,17)	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
University College London Curated by ChEMBL					Assay Description Inhibition of HDAC in rat liver homogenate				J Med Chem 49: 800-5 (2006) Article DOI: 10.1021/jm051010j BindingDB Entry DOI: 10.7270/Q2JW8HN9
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50475558 (6-(4-Dimethylaminophenylsulfinyl)Hexanoic Acid Hyd...) Show SMILES CN(C)c1ccc(cc1)[S+]([O-])CCCCCC(=O)NO Show InChI InChI=1S/C14H22N2O3S/c1-16(2)12-7-9-13(10-8-12)20(19)11-5-3-4-6-14(17)15-18/h7-10,18H,3-6,11H2,1-2H3,(H,15,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University College London Curated by ChEMBL					Assay Description Inhibition of HDAC in human leukemic CEM cells				J Med Chem 49: 800-5 (2006) Article DOI: 10.1021/jm051010j BindingDB Entry DOI: 10.7270/Q2JW8HN9
					More data for this Ligand-Target Pair