Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cruzipain' and Ligand = 'BDBM50386186'   

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
Cruzipain (Trypanosoma cruzi)	BDBM50386186 (CHEMBL2042788) Show SMILES Oc1ccccc1\C=N\NC(=O)\C=C\c1ccc2OCOc2c1 Show InChI InChI=1S/C17H14N2O4/c20-14-4-2-1-3-13(14)10-18-19-17(21)8-6-12-5-7-15-16(9-12)23-11-22-15/h1-10,20H,11H2,(H,19,21)/b8-6+,18-10+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
Instituto de Tecnologia em F£rmacos - Farmanguinhos Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi C-terminally truncated cruzain expressed in Escherichia coli using Z-Phe-Arg-AMC as substrate incubated for 5 mins pr...				Eur J Med Chem 54: 512-21 (2012) Article DOI: 10.1016/j.ejmech.2012.05.041 BindingDB Entry DOI: 10.7270/Q2HM59HT
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