BDBM50437951 CHEMBL2408922::US9403843, 24a

SMILES CC(C)C[C@H](NC(=O)[C@H]1O[C@@H]1C(O)=O)C(=O)Nc1nc(cs1)-c1ccc(F)cc1

InChI Key InChIKey=WVMZJHSGEWZNEO-UHFFFAOYSA-N

Data  3 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50437951   

TargetCalpain-1 catalytic subunit(Human)
Columbia University

US Patent
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataIC50: 30nMpH: 7.4Assay Description:The Calbiochem InnoZyme activity kit was used for measuring the inhibition effect inhibitors on human erythrocyte calpain 1 activity. A calpain FRET ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2017
Entry Details
Go to US Patent

TargetCalpain-1 catalytic subunit(Human)
Columbia University

US Patent
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataIC50: 50nMpH: 7.4Assay Description:The Calbiochem InnoZyme activity kit was used for measuring the inhibition effect inhibitors on human erythrocyte calpain 1 activity. A calpain FRET ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2017
Entry Details
Go to US Patent

TargetCalpain-1 catalytic subunit(Human)
Columbia University

US Patent
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataIC50: 250nMpH: 7.4Assay Description:The Calbiochem InnoZyme activity kit was used for measuring the inhibition effect inhibitors on human erythrocyte calpain 1 activity. A calpain FRET ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2017
Entry Details
Go to US Patent

TargetPapain(Papaya)
University of Illinois College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataKi:  1.62E+3nMAssay Description:Inhibition of papain after using SucLLVYAMC as substrate by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCalpain-1 catalytic subunit(Pig)
Columbia University

US Patent
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataKi:  6.00E+3nM ΔG°:  -7.24kcal/molepH: 7.6 T: 2°CAssay Description:Full length porcine calpain (156 nM), or papain (236 pM) was added to a solution of 100 mM NaCl, 50 mM HEPES, pH 7.6, 1 mM TCEP, 30 μM Suc-LLVY-AM...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/31/2017
Entry Details
Go to US Patent

TargetCalpain-1 catalytic subunit(Pig)
Columbia University

US Patent
LigandPNGBDBM50437951(CHEMBL2408922 | US9403843, 24a)
Affinity DataKi:  6.02E+3nMAssay Description:Inhibition of pig full length Cal1 after using SucLLVYAMC as substrate by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed