Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 7' and Ligand = 'BDBM50279714'   

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 7 (Homo sapiens (Human))	BDBM50279714 (CHEMBL4162168) Show SMILES [#6]-[#6](-[#6])-[#6@@H](-[#6][Se;v2]c1ccc(cc1)S([#7])(=O)=O)-[#7]S(=O)(=O)c1ccc(-[#6])cc1 |r| Show InChI InChI=1S/C18H24N2O4S2Se/c1-13(2)18(20-26(23,24)16-6-4-14(3)5-7-16)12-27-17-10-8-15(9-11-17)25(19,21)22/h4-11,13,18,20H,12H2,1-3H3,(H2,19,21,22)/t18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 7 incubated for 15 mins by stopped flow CO2 hydrase assay				ACS Med Chem Lett 8: 1213-1217 (2017) Article DOI: 10.1021/acsmedchemlett.7b00387 BindingDB Entry DOI: 10.7270/Q22Z182G
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