BDBM50090645 (S)-2-Benzyl-N-[(S)-4-guanidino-1-(2-oxo-acetyl)-butyl]-malonamic acid benzyl ester::CHEMBL51128

SMILES: NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)C(=O)OCc1ccccc1)C(=O)C=O

InChI Key: InChIKey=IPOQILCXZOXJQX-PMACEKPBSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50090645   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cathepsin B (Bos taurus (bovine))	BDBM50090645 ((S)-2-Benzyl-N-[(S)-4-guanidino-1-(2-oxo-acetyl)-b...) Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)C(=O)OCc1ccccc1)C(=O)C=O Show InChI InChI=1S/C24H28N4O5/c25-24(26)27-13-7-12-20(21(30)15-29)28-22(31)19(14-17-8-3-1-4-9-17)23(32)33-16-18-10-5-2-6-11-18/h1-6,8-11,15,19-20H,7,12-14,16H2,(H,28,31)(H4,25,26,27)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	40	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
Procathepsin L (Homo sapiens (Human))	BDBM50090645 ((S)-2-Benzyl-N-[(S)-4-guanidino-1-(2-oxo-acetyl)-b...) Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)C(=O)OCc1ccccc1)C(=O)C=O Show InChI InChI=1S/C24H28N4O5/c25-24(26)27-13-7-12-20(21(30)15-29)28-22(31)19(14-17-8-3-1-4-9-17)23(32)33-16-18-10-5-2-6-11-18/h1-6,8-11,15,19-20H,7,12-14,16H2,(H,28,31)(H4,25,26,27)/t19-,20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	90	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 L-catalyzed hydrolysis of the fluorogenic substrate Z-Phe-Arg-NHMec				Bioorg Med Chem Lett 10: 1771-3 (2000) BindingDB Entry DOI: 10.7270/Q2TQ60SW
					More data for this Ligand-Target Pair