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Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin B' and Ligand = 'BDBM50042435'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Cathepsin B


(Bos taurus (bovine))		BDBM50042435
PNG
(3-(2-Isobutoxycarbonylamino-4-methyl-pentanoylamin...)
Show SMILES CCOC(=O)C(=O)C(CC)NC(=O)C(CC(C)C)NC(=O)OCC(C)C
Show InChI InChI=1S/C18H32N2O6/c1-7-13(15(21)17(23)25-8-2)19-16(22)14(9-11(3)4)20-18(24)26-10-12(5)6/h11-14H,7-10H2,1-6H3,(H,19,22)(H,20,24)
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PC cid
PC sid
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PubMed
 400n/an/an/an/an/an/a5.2n/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Inhibition of alpha-keto esters towards cathepsin B at pH 5.2

J Med Chem 36: 3472-80 (1993)


BindingDB Entry DOI: 10.7270/Q2F76BK3
More data for this
Ligand-Target Pair