BDBM50343069 (S)-3-(2-(3,4-dihydroxybenzylidene)butanamido)-N-(4-methoxyphenethyl)-2-oxo-4-phenylbutanamide::CHEMBL1770880

SMILES: CCC(=Cc1ccc(O)c(O)c1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCc1ccc(OC)cc1

InChI Key: InChIKey=UWJVIXZEXAEJDI-VWLOTQADSA-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 = 50343069   

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
Calpain1 (Homo sapiens (Human))	BDBM50343069 ((S)-3-(2-(3,4-dihydroxybenzylidene)butanamido)-N-(...) Show SMILES CCC(=Cc1ccc(O)c(O)c1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCc1ccc(OC)cc1 |r,w:3.3| Show InChI InChI=1S/C30H32N2O6/c1-3-23(17-22-11-14-26(33)27(34)19-22)29(36)32-25(18-21-7-5-4-6-8-21)28(35)30(37)31-16-15-20-9-12-24(38-2)13-10-20/h4-14,17,19,25,33-34H,3,15-16,18H2,1-2H3,(H,31,37)(H,32,36)/t25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
College of Pharmacy Kyung Hee University Curated by ChEMBL					Assay Description Inhibition of human erythrocytes mu-calpain using Suc-Leu-Tyr-AMC fluorogenic substrate after 30 mins by spectrofluorimetery				Bioorg Med Chem Lett 21: 2850-4 (2011) Article DOI: 10.1016/j.bmcl.2011.03.077 BindingDB Entry DOI: 10.7270/Q27P8ZQQ
					More data for this Ligand-Target Pair