Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50484769'   

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 (Homo sapiens (Human))	BDBM50484769 (CHEMBL1958429) Show SMILES ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc1ccc(OC(F)F)cc1 Show InChI InChI=1S/C16H14F2N2O5S/c17-16(18)25-13-7-5-12(6-8-13)20-26(23,24)14-3-1-2-11(10-14)4-9-15(21)19-22/h1-10,16,20,22H,(H,19,21)/b9-4+	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	10	n/a	n/a	n/a	n/a	n/a	n/a
London School of Hygiene and Tropical Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC expressed in human HeLa cells after 1 hr by fluorescence analysis				Bioorg Med Chem Lett 22: 1886-90 (2012) Article DOI: 10.1016/j.bmcl.2012.01.072 BindingDB Entry DOI: 10.7270/Q2QF8WQT
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