Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cruzipain' and Ligand = 'BDBM50119312'   

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)	BDBM50119312 (CHEMBL316864 | {(S)-1-[2,5-Dioxo-1-(3-phenyl-propy...) Show SMILES O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC(=O)N(CCCc2ccccc2)CC1=O)OCc1ccccc1 Show InChI InChI=1S/C31H33N3O5/c35-28-21-34(18-10-17-23-11-4-1-5-12-23)29(36)20-26(28)32-30(37)27(19-24-13-6-2-7-14-24)33-31(38)39-22-25-15-8-3-9-16-25/h1-9,11-16,26-27H,10,17-22H2,(H,32,37)(H,33,38)/t26?,27-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Affinity for cysteine protease (Cruzipain) of Chagas' disease				Bioorg Med Chem Lett 12: 2993-6 (2002) BindingDB Entry DOI: 10.7270/Q2W37VPP
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM50119312 (CHEMBL316864 | {(S)-1-[2,5-Dioxo-1-(3-phenyl-propy...) Show SMILES O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC(=O)N(CCCc2ccccc2)CC1=O)OCc1ccccc1 Show InChI InChI=1S/C31H33N3O5/c35-28-21-34(18-10-17-23-11-4-1-5-12-23)29(36)20-26(28)32-30(37)27(19-24-13-6-2-7-14-24)33-31(38)39-22-25-15-8-3-9-16-25/h1-9,11-16,26-27H,10,17-22H2,(H,32,37)(H,33,38)/t26?,27-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	16.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Affinity for cysteine protease (Cruzipain) of Chagas' disease				Bioorg Med Chem Lett 12: 2993-6 (2002) BindingDB Entry DOI: 10.7270/Q2W37VPP
					More data for this Ligand-Target Pair