Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cathepsin B' and Ligand = 'BDBM50045438'   

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 (Capra hircus (Goat))	BDBM50045438 (CHEMBL3309798) Show SMILES CC(=O)N1N=C(CC1c1ccc(cc1)[N+]([O-])=O)c1ccccc1 |c:4| Show InChI InChI=1S/C17H15N3O3/c1-12(21)19-17(14-7-9-15(10-8-14)20(22)23)11-16(18-19)13-5-3-2-4-6-13/h2-10,17H,11H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Non-competitive inhibition of goat liver cathepsin B using BANA substrate by Lineweaver-Burk plot analysis				Bioorg Med Chem 22: 4233-45 (2014) Article DOI: 10.1016/j.bmc.2014.05.037 BindingDB Entry DOI: 10.7270/Q25Q4XQH
					More data for this Ligand-Target Pair
Cathepsin B (Capra hircus (Goat))	BDBM50045438 (CHEMBL3309798) Show SMILES CC(=O)N1N=C(CC1c1ccc(cc1)[N+]([O-])=O)c1ccccc1 |c:4| Show InChI InChI=1S/C17H15N3O3/c1-12(21)19-17(14-7-9-15(10-8-14)20(22)23)11-16(18-19)13-5-3-2-4-6-13/h2-10,17H,11H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kurukshetra University Curated by ChEMBL					Assay Description Inhibition of goat liver cathepsin B using BANA substrate pre-incubated 30 mins before substrate addition by colorimetry				Bioorg Med Chem 22: 4233-45 (2014) Article DOI: 10.1016/j.bmc.2014.05.037 BindingDB Entry DOI: 10.7270/Q25Q4XQH
					More data for this Ligand-Target Pair