Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 1' and Ligand = 'BDBM239062'   

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))	BDBM239062 (US10227295, Compound 10b | US9409858, 10b) Show SMILES CC(C)[C@H]1N(Cc2ccc(cc2)C(=O)NO)C(=O)N(C1=O)c1ccccc1 |r| Show InChI InChI=1S/C20H21N3O4/c1-13(2)17-19(25)23(16-6-4-3-5-7-16)20(26)22(17)12-14-8-10-15(11-9-14)18(24)21-27/h3-11,13,17,27H,12H2,1-2H3,(H,21,24)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R&D) Ltd					Assay Description HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...				J Med Chem 51: 196-218 (2008) BindingDB Entry DOI: 10.7270/Q2VD71RF
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM239062 (US10227295, Compound 10b | US9409858, 10b) Show SMILES CC(C)[C@H]1N(Cc2ccc(cc2)C(=O)NO)C(=O)N(C1=O)c1ccccc1 |r| Show InChI InChI=1S/C20H21N3O4/c1-13(2)17-19(25)23(16-6-4-3-5-7-16)20(26)22(17)12-14-8-10-15(11-9-14)18(24)21-27/h3-11,13,17,27H,12H2,1-2H3,(H,21,24)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	8.0	n/a
H. Lee Moffitt Cancer Center and Research Institute, Inc.; Board of Trustees of the University of Illinois US Patent					Assay Description HDAC inhibition assays were performed by Reaction Biology Corp. (Malvern, Pa.) using isolated human, recombinant full-length HDAC1 and -6 from a bacu...				US Patent US9409858 (2016) BindingDB Entry DOI: 10.7270/Q21V5CWN
					More data for this Ligand-Target Pair