Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 4' and Ligand = 'BDBM50079062'   

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
Carbonic anhydrase 4 (Bos taurus (bovine))	BDBM50079062 (6-[2-(2-Sulfamoyl-benzothiazol-6-yloxy)-ethoxycarb...) Show SMILES NS(=O)(=O)c1nc2ccc(OCCONC(=O)c3cccc(n3)C(O)=O)cc2s1 Show InChI InChI=1S/C16H14N4O7S2/c17-29(24,25)16-19-10-5-4-9(8-13(10)28-16)26-6-7-27-20-14(21)11-2-1-3-12(18-11)15(22)23/h1-5,8H,6-7H2,(H,20,21)(H,22,23)(H2,17,24,25)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi Curated by ChEMBL					Assay Description Inhibitory activity against bovine lung microsomes carbonic anhydrase isozyme IV (bCA IV).				J Med Chem 42: 2641-50 (1999) Article DOI: 10.1021/jm9900523 BindingDB Entry DOI: 10.7270/Q2J67HMK
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