Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cruzipain' and Ligand = 'BDBM50502841'   

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)	BDBM50502841 (CHEMBL4447597) Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](c1cccc(Cl)c1)C(F)(F)F |r| Show InChI InChI=1S/C19H16ClF3N2O2/c20-13-5-3-4-11(8-13)17(19(21,22)23)25-16(18(26)27)9-12-10-24-15-7-2-1-6-14(12)15/h1-8,10,16-17,24-25H,9H2,(H,26,27)/t16-,17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	141	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi cruzain assessed as inhibitor constant using Z-Phe-Arg-7-amido-4-methylcoumarin as substrate preincubated for 2 mins ...				Bioorg Med Chem 27: (2019) Article DOI: 10.1016/j.bmc.2019.115083 BindingDB Entry DOI: 10.7270/Q29P34WR
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