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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Calpain-2 catalytic subunit' and Ligand = 'BDBM50263613'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Calpain-2 catalytic subunit


(Sus scrofa)		BDBM50263613
PNG
(2-(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)ethyl (S)-1...)
Show SMILES COCCOCCOCCOCCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)C(=O)NC1CC1 |r|
Show InChI InChI=1S/C29H45N3O9/c1-21(2)19-25(32-29(36)41-18-17-40-16-15-39-14-13-38-12-11-37-3)27(34)31-24(20-22-7-5-4-6-8-22)26(33)28(35)30-23-9-10-23/h4-8,21,23-25H,9-20H2,1-3H3,(H,30,35)(H,31,34)(H,32,36)/t24-,25-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 170n/an/an/an/an/an/a



Senju Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of pig kidney m-calpain

Bioorg Med Chem Lett 18: 5174-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.089
BindingDB Entry DOI: 10.7270/Q2P55NBS
More data for this
Ligand-Target Pair