BDBM50343075 (S)-2-(4-hydroxy-3-methoxybenzylidene)-N-(4-(4-methoxyphenethylamino)-3,4-dioxo-1-phenylbutan-2-yl)hexanamide::CHEMBL1771026

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

InChI Key: InChIKey=ZVFVCZGDAPWMJD-NDEPHWFRSA-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 = 50343075   

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))	BDBM50343075 ((S)-2-(4-hydroxy-3-methoxybenzylidene)-N-(4-(4-met...) Show SMILES CCCCC(=Cc1ccc(O)c(OC)c1)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NCCc1ccc(OC)cc1 |r,w:5.5| Show InChI InChI=1S/C33H38N2O6/c1-4-5-11-26(20-25-14-17-29(36)30(22-25)41-3)32(38)35-28(21-24-9-7-6-8-10-24)31(37)33(39)34-19-18-23-12-15-27(40-2)16-13-23/h6-10,12-17,20,22,28,36H,4-5,11,18-19,21H2,1-3H3,(H,34,39)(H,35,38)/t28-/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	630	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