Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50373690'   

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))	BDBM50373690 (CHEMBL271652) Show SMILES COc1ccc(cc1OC)-c1cc(Cl)nc(NCc2ccc(cc2)C(=O)Nc2ccccc2N)n1 Show InChI InChI=1S/C26H24ClN5O3/c1-34-22-12-11-18(13-23(22)35-2)21-14-24(27)32-26(31-21)29-15-16-7-9-17(10-8-16)25(33)30-20-6-4-3-5-19(20)28/h3-14H,15,28H2,1-2H3,(H,30,33)(H,29,31,32)	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	100	n/a	n/a	n/a	n/a	n/a	n/a
MethylGene Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1				Bioorg Med Chem Lett 18: 1067-71 (2008) Article DOI: 10.1016/j.bmcl.2007.12.009 BindingDB Entry DOI: 10.7270/Q2ZW1MSD
					More data for this Ligand-Target Pair