Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM50545155'   

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))	BDBM50545155 (CHEMBL4639703) Show SMILES Nc1cc(F)ccc1NC(=O)CCCCNC(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F Show InChI InChI=1S/C27H25F2N5O3/c28-17-9-11-23(22(30)15-17)32-25(35)7-3-4-12-31-26(36)20-13-16(8-10-21(20)29)14-24-18-5-1-2-6-19(18)27(37)34-33-24/h1-2,5-6,8-11,13,15H,3-4,7,12,14,30H2,(H,31,36)(H,32,35)(H,34,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hefei University of Technology Curated by ChEMBL					Assay Description Inhibition of HDAC1 (unknown origin)				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127036 BindingDB Entry DOI: 10.7270/Q28G8Q9P
					More data for this Ligand-Target Pair