Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50112644'   

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 9 (Homo sapiens (Human))	BDBM50112644 (CHEMBL3609434) Show SMILES CC(=O)O[C@@H]1COC(NS(=O)(=O)ON)C=C1 |r,c:14| Show InChI InChI=1S/C7H12N2O6S/c1-5(10)14-6-2-3-7(13-4-6)9-16(11,12)15-8/h2-3,6-7,9H,4,8H2,1H3/t6-,7?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut des Biomol£cules Max Mousseron (IBMM) UMR 5247 CNRS-ENSCM-Universit£ de Montpellier Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase-9 catalytic domain by stopped-flow CO2 hydration assay				ACS Med Chem Lett 6: 819-21 (2015) Article DOI: 10.1021/acsmedchemlett.5b00175 BindingDB Entry DOI: 10.7270/Q2NZ89D9
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