Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 9' and Ligand = 'BDBM50531509'   

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))	BDBM50531509 (CHEMBL4590900) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1noc(n1)C1CC1 Show InChI InChI=1S/C11H11N3O3S/c12-18(15,16)9-5-3-7(4-6-9)10-13-11(17-14-10)8-1-2-8/h3-6,8H,1-2H2,(H2,12,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 assessed as reduction in CO2 hydration after 15 mins by phenol red staining-based stopped flow assay				Eur J Med Chem 164: 92-105 (2019) Article DOI: 10.1016/j.ejmech.2018.12.049 BindingDB Entry DOI: 10.7270/Q2R78JPG
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