Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50341839'   

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 1 (Homo sapiens (Human))	BDBM50341839 (5-(3-Aminophenyl)-N-(7-(hydroxyimino)-8-(methylami...) Show SMILES CNC(=O)C(CCCCCCNC(=O)c1cc(on1)-c1cccc(N)c1)N=O Show InChI InChI=1S/C19H25N5O4/c1-21-18(25)15(23-27)9-4-2-3-5-10-22-19(26)16-12-17(28-24-16)13-7-6-8-14(20)11-13/h6-8,11-12,15H,2-5,9-10,20H2,1H3,(H,21,25)(H,22,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universita` degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of human HDAC1 using ArgHisLysLys(Ac) fluorogenic peptide as a substrate by fluorimetric assay				J Med Chem 54: 2165-82 (2011) Article DOI: 10.1021/jm101373a BindingDB Entry DOI: 10.7270/Q2CR5TNZ
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