Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50477647'   

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))	BDBM50477647 (CHEMBL251183) Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ncc(s1)C(=O)NO Show InChI InChI=1S/C16H20N4O6S2/c1-25-12-4-3-11(9-13(12)26-2)28(23,24)20-7-5-19(6-8-20)16-17-10-14(27-16)15(21)18-22/h3-4,9-10,22H,5-8H2,1-2H3,(H,18,21)	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	70	n/a	n/a	n/a	n/a	n/a	n/a
EntreMed Inc. Curated by ChEMBL					Assay Description Inhibition of HDAC activity in HeLa cell nuclear extract by fluorescent assay				Bioorg Med Chem Lett 17: 5995-9 (2007) Article DOI: 10.1016/j.bmcl.2007.07.050 BindingDB Entry DOI: 10.7270/Q24X5BKT
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