Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50475562'   

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)	BDBM50475562 (CHEMBL383285) Show SMILES CN(C)c1ccc(Sc2cccc(\C=C\C(=O)NO)c2)cc1 Show InChI InChI=1S/C17H18N2O2S/c1-19(2)14-7-9-15(10-8-14)22-16-5-3-4-13(12-16)6-11-17(20)18-21/h3-12,21H,1-2H3,(H,18,20)/b11-6+	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	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))	BDBM50475562 (CHEMBL383285) Show SMILES CN(C)c1ccc(Sc2cccc(\C=C\C(=O)NO)c2)cc1 Show InChI InChI=1S/C17H18N2O2S/c1-19(2)14-7-9-15(10-8-14)22-16-5-3-4-13(12-16)6-11-17(20)18-21/h3-12,21H,1-2H3,(H,18,20)/b11-6+	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	8.60E+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