Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin B' and Ligand = 'BDBM50090646'   

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
Cathepsin B (Bos taurus (bovine))	BDBM50090646 ((S)-2-Acetylamino-5-guanidino-pentanoic acid [(S)-...) Show SMILES CC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)C=O Show InChI InChI=1S/C15H28N8O4/c1-9(25)22-11(5-3-7-21-15(18)19)13(27)23-10(12(26)8-24)4-2-6-20-14(16)17/h8,10-11H,2-7H2,1H3,(H,22,25)(H,23,27)(H4,16,17,20)(H4,18,19,21)/t10-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	640	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Queen's University Belfast Curated by ChEMBL					Assay Description Ability to block cathepsin B-catalyzed hydrolysis of the fluorogenic substrate Z-Arg-Arg-NHMec				Bioorg Med Chem Lett 10: 1771-3 (2000) BindingDB Entry DOI: 10.7270/Q2TQ60SW
					More data for this Ligand-Target Pair