Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cruzipain' and Ligand = 'BDBM50229125'   

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)	BDBM50229125 (CHEMBL442284 | N-((S)-1-oxo-1-((S)-5-phenyl-1-(phe...) Show SMILES Cc1cccc(C[C@H](NC(=O)c2ccccn2)C(=O)N[C@@H](CCc2ccccc2)\C=C\S(=O)(=O)c2ccccc2)c1 Show InChI InChI=1S/C33H33N3O4S/c1-25-11-10-14-27(23-25)24-31(36-32(37)30-17-8-9-21-34-30)33(38)35-28(19-18-26-12-4-2-5-13-26)20-22-41(39,40)29-15-6-3-7-16-29/h2-17,20-23,28,31H,18-19,24H2,1H3,(H,35,38)(H,36,37)/b22-20+/t28-,31-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain				Bioorg Med Chem Lett 18: 624-8 (2008) Article DOI: 10.1016/j.bmcl.2007.11.070 BindingDB Entry DOI: 10.7270/Q2DN44SC
					More data for this Ligand-Target Pair