Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50351943'   

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))	BDBM50351943 (CHEMBL1822042) Show SMILES CC(C)CCc1c(O)c(CCC(=O)NO)ccc1OCCCCCCC(=O)NO Show InChI InChI=1S/C21H34N2O6/c1-15(2)8-11-17-18(29-14-6-4-3-5-7-19(24)22-27)12-9-16(21(17)26)10-13-20(25)23-28/h9,12,15,26-28H,3-8,10-11,13-14H2,1-2H3,(H,22,24)(H,23,25)	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	42.9	n/a	n/a	n/a	n/a	n/a	n/a
Taipei Medical University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using KI-177 as substrate incubated 30 mins before substrate addition measured after 30 mins post substrate addition by fluoresce...				Eur J Med Chem 46: 4042-9 (2011) Article DOI: 10.1016/j.ejmech.2011.06.002 BindingDB Entry DOI: 10.7270/Q2ZS2WWD
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