Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Papain' and Ligand = 'BDBM50265075'   

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
Papain (Carica papaya)	BDBM50265075 (CHEMBL498580 | Cbz-Phe-Gly-epoxide) Show SMILES O=C(N[C@@H](Cc1ccccc1)C(=O)NCC1CO1)OCc1ccccc1 |r| Show InChI InChI=1S/C20H22N2O4/c23-19(21-12-17-14-25-17)18(11-15-7-3-1-4-8-15)22-20(24)26-13-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H,21,23)(H,22,24)/t17?,18-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bar Ilan University Curated by ChEMBL					Assay Description Binding affinity to Carica papaya papain treated up to 2 hrs at 25 degC by Dixon plot				Bioorg Med Chem 16: 9032-9 (2008) Article DOI: 10.1016/j.bmc.2008.08.031 BindingDB Entry DOI: 10.7270/Q2XP74SH
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