Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Arylsulfatase' AND taxid = 573   

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
Arylsulfatase (Klebsiella pneumoniae)	BDBM50400983 (CHEMBL2205726) Show SMILES [NH3+]CCOCCOCCNC(=O)C(F)c1ccc(OS([O-])(=O)=O)cc1 Show InChI InChI=1S/C14H21FN2O7S/c15-13(11-1-3-12(4-2-11)24-25(19,20)21)14(18)17-6-8-23-10-9-22-7-5-16/h1-4,13H,5-10,16H2,(H,17,18)(H,19,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Bielefeld University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae aryl sulfatase after 0.5 hrs by para-nitrocatechol sulfate-based colorimetric assay				Bioorg Med Chem 20: 622-7 (2012) Article DOI: 10.1016/j.bmc.2011.04.044 BindingDB Entry DOI: 10.7270/Q2MP54FG
					More data for this Ligand-Target Pair
Arylsulfatase (Klebsiella pneumoniae)	BDBM50400984 (CHEMBL2205725) Show SMILES OS(=O)(=O)Oc1ccccc1C(F)F Show InChI InChI=1S/C7H6F2O4S/c8-7(9)5-3-1-2-4-6(5)13-14(10,11)12/h1-4,7H,(H,10,11,12)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
Bielefeld University Curated by ChEMBL					Assay Description Inhibition of Klebsiella pneumoniae aryl sulfatase after 20 mins by spectrophotometry				Bioorg Med Chem 20: 622-7 (2012) Article DOI: 10.1016/j.bmc.2011.04.044 BindingDB Entry DOI: 10.7270/Q2MP54FG
					More data for this Ligand-Target Pair