Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50475568'   

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)	BDBM50475568 (CHEMBL201075) Show SMILES COc1ccc(cc1)[S+]([O-])C\C=C\C=C\C(=O)NO Show InChI InChI=1S/C13H15NO4S/c1-18-11-6-8-12(9-7-11)19(17)10-4-2-3-5-13(15)14-16/h2-9,16H,10H2,1H3,(H,14,15)/b4-2+,5-3+	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	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))	BDBM50475568 (CHEMBL201075) Show SMILES COc1ccc(cc1)[S+]([O-])C\C=C\C=C\C(=O)NO Show InChI InChI=1S/C13H15NO4S/c1-18-11-6-8-12(9-7-11)19(17)10-4-2-3-5-13(15)14-16/h2-9,16H,10H2,1H3,(H,14,15)/b4-2+,5-3+	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	5.40E+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