Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50474469'   

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))	BDBM50474469 (CHEMBL347068) Show SMILES ONC(=O)\C=C\c1ccc(CNC(=O)c2ccccn2)cc1 Show InChI InChI=1S/C16H15N3O3/c20-15(19-22)9-8-12-4-6-13(7-5-12)11-18-16(21)14-3-1-2-10-17-14/h1-10,22H,11H2,(H,18,21)(H,19,20)/b9-8+	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	942	n/a	n/a	n/a	n/a	n/a	n/a
In2Gen Co. Ltd. Curated by ChEMBL					Assay Description Inhibitory activity against Histone deacetylase (HDAC) from SNU-16 (human gastric adenocarcinoma) cells				J Med Chem 46: 5745-51 (2003) Article DOI: 10.1021/jm030377q BindingDB Entry DOI: 10.7270/Q2639SGQ
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