Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Urease' and Ligand = 'BDBM50488920'   

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
Urease (Canavalia ensiformis (Jack bean) (Horse bean))	BDBM50488920 (CHEMBL2298019) Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC(=O)c2cccc(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C14H12N4O5S2/c15-25(22,23)12-6-4-10(5-7-12)16-14(24)17-13(19)9-2-1-3-11(8-9)18(20)21/h1-8H,(H2,15,22,23)(H2,16,17,19,24)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article	450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Canavalia ensiformis (jack bean) urease assessed as release of ammonia after 30 min by indophenol method				Citation and Details Article DOI: 10.1007/s00044-012-0376-4 BindingDB Entry DOI: 10.7270/Q2P84FT7
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