BDBM50292159 (S)-N'-[(S)-2-((S)-2-Benzyloxycarbonylamino-propionylamino)-propionyl]-N-carbamoylmethyl-hydrazinecarboxylic acid 2-benzylcarbamoyl-vinyl ester::CHEMBL55249

SMILES: C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)NN(CC(N)=O)C(=O)O\C=C\C(=O)NCc1ccccc1

InChI Key: InChIKey=PYEWPFPNIWTDSK-NUPXTWTDSA-N

Data: 1 IC50

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 1 hit for monomerid = 50292159   

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
Legumain (Homo sapiens (Human))	BDBM50292159 ((S)-N'-[(S)-2-((S)-2-Benzyloxycarbonylamino-propio...) Show SMILES C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)C(=O)NN(CC(N)=O)C(=O)O\C=C\C(=O)NCc1ccccc1 Show InChI InChI=1S/C27H32N6O8/c1-18(31-26(38)41-17-21-11-7-4-8-12-21)24(36)30-19(2)25(37)32-33(16-22(28)34)27(39)40-14-13-23(35)29-15-20-9-5-3-6-10-20/h3-14,18-19H,15-17H2,1-2H3,(H2,28,34)(H,29,35)(H,30,36)(H,31,38)(H,32,37)/b14-13+/t18-,19-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
School of Chemistry and Biochemistry and the Parker H. Petit Institute for Bioengineering and Bioscience Curated by ChEMBL					Assay Description Inhibitory concentration of the compound was evaluated for irreversible inhibition of S. mansoni Legumain				J Med Chem 47: 1889-92 (2004) Article DOI: 10.1021/jm049938j BindingDB Entry DOI: 10.7270/Q2BZ65G0
					More data for this Ligand-Target Pair