Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase' and Ligand = 'BDBM50161468'   

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))	BDBM50161468 (CHEMBL3794127) Show SMILES [#6]\[#6](-[#6])=[#6](\c1ccccc1)-c1ccc(\[#6]=[#6]\[#6](=O)-[#7]-[#8])cc1 Show InChI InChI=1S/C19H19NO2/c1-14(2)19(16-6-4-3-5-7-16)17-11-8-15(9-12-17)10-13-18(21)20-22/h3-13,22H,1-2H3,(H,20,21)/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Milan Curated by ChEMBL					Assay Description Inhibition of HDAC in human HeLa cells using BOC-Ac-Lys-AMC as substrate incubated for 4 hrs by fluorescence assay				Eur J Med Chem 112: 99-105 (2016) Article DOI: 10.1016/j.ejmech.2016.02.001 BindingDB Entry DOI: 10.7270/Q2HM5BB0
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50161468 (CHEMBL3794127) Show SMILES [#6]\[#6](-[#6])=[#6](\c1ccccc1)-c1ccc(\[#6]=[#6]\[#6](=O)-[#7]-[#8])cc1 Show InChI InChI=1S/C19H19NO2/c1-14(2)19(16-6-4-3-5-7-16)17-11-8-15(9-12-17)10-13-18(21)20-22/h3-13,22H,1-2H3,(H,20,21)/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Milan Curated by ChEMBL					Assay Description Inhibition of HDAC in human HeLa nuclear extract using BOC-Ac-Lys-AMC as substrate incubated for 90 mins by fluorescence assay				Eur J Med Chem 112: 99-105 (2016) Article DOI: 10.1016/j.ejmech.2016.02.001 BindingDB Entry DOI: 10.7270/Q2HM5BB0
					More data for this Ligand-Target Pair