Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Catalytic domain 1 (zCD1)'   

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 6 [60-420] (Danio rerio)	BDBM198120 (TSA) Show SMILES CC(\C=C\C(=O)NO)\C=C(/C)C(=O)c1ccc(cc1)N(C)C Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-12,22H,1-4H3,(H,18,20)/b10-5+,13-11+	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.80	-47.5	7	n/a	n/a	n/a	n/a	n/a	25
University of Pennsylvania,					Assay Description The fluorescence anisotropy assay was performed with fluorescein-labeled SAHA (fl-SAHA, gift of C. Fierke, University of Michigan) and measured using...				Nat Chem Biol 12: 741-747 (2016) Article DOI: 10.1038/nchembio.2134 BindingDB Entry DOI: 10.7270/Q2TH8KH1
					More data for this Ligand-Target Pair
Histone deacetylase 6 [60-420] (Danio rerio)	BDBM198125 (fl-SAHA) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12 |(29.64,-15.16,;28.31,-15.93,;26.97,-15.16,;26.97,-13.62,;25.64,-15.93,;24.31,-15.16,;22.97,-15.93,;21.64,-15.16,;20.31,-15.93,;18.97,-15.16,;17.64,-15.93,;17.64,-17.47,;16.3,-15.16,;14.97,-15.93,;13.64,-15.16,;12.3,-15.93,;12.3,-17.47,;13.64,-18.24,;14.97,-17.47,;14.41,-19.57,;15.95,-19.57,;13.64,-20.9,;10.97,-18.24,;9.64,-17.47,;9.64,-15.93,;8.3,-15.16,;6.97,-15.93,;5.48,-15.53,;6.97,-17.47,;8.3,-18.24,;8.3,-19.78,;9.64,-20.55,;9.64,-22.09,;10.97,-22.86,;10.97,-24.4,;12.3,-22.09,;12.3,-20.55,;10.97,-19.78,)| Show InChI InChI=1S/C28H26N2O8/c31-17-8-11-20-23(14-17)38-24-15-18(32)9-12-21(24)27(20)19-10-7-16(13-22(19)28(35)36)29-25(33)5-3-1-2-4-6-26(34)30-37/h7-15,31,37H,1-6H2,(H,29,33)(H,30,34)(H,35,36)	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	25
University of Pennsylvania,					Assay Description The fluorescence anisotropy assay was performed with fluorescein-labeled SAHA (fl-SAHA, gift of C. Fierke, University of Michigan) and measured using...				Nat Chem Biol 12: 741-747 (2016) Article DOI: 10.1038/nchembio.2134 BindingDB Entry DOI: 10.7270/Q2TH8KH1
					More data for this Ligand-Target Pair