BDBM18447 2-({4-[(5-chloro-2-methoxyphenyl)amino]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl}amino)ethan-1-ol::NCGC00029010::Triazine compound, 3::triazine scaffold, 1

SMILES COc1ccc(Cl)cc1Nc1nc(NCCO)nc(n1)N1CCCC1

InChI Key InChIKey=AQYDNGDNBIIYOX-UHFFFAOYSA-N

Data  1 KI  4 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 4 hits for monomerid = 18447   

LigandPNGBDBM18447(triazine scaffold, 1 | 2-({4-[(5-chloro-2-methoxyp...)
Affinity DataIC50: 700nMpH: 5.9 T: 2°CAssay Description:Enzyme activity was determined as the production of fluorescent resorufin from the substrate. The fluorescence was measured (excitation 570 nm, emiss...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2007
Entry Details Article
PubMed
LigandPNGBDBM18447(triazine scaffold, 1 | 2-({4-[(5-chloro-2-methoxyp...)
Affinity DataIC50: 7.90E+3nMAssay Description:Inhibition of wild type glucocerebrosidase in human spleen homogenate using 4-methylumbellifereno-Glc as substrate incubated for 5 mins prior to subs...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
LigandPNGBDBM18447(triazine scaffold, 1 | 2-({4-[(5-chloro-2-methoxyp...)
Affinity DataIC50: 400nMAssay Description:Inhibition of wild type glucocerebrosidase using 4-methylumbellifereno-Glc as substrate incubated for 5 mins prior to substrate addition measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
LigandPNGBDBM18447(triazine scaffold, 1 | 2-({4-[(5-chloro-2-methoxyp...)
Affinity DataKi:  320nM ΔG°:  -8.74kcal/mole IC50: 430nMpH: 5.9 T: 2°CAssay Description:Enzyme activity was determined as the production of fluorescent resorufin from the substrate. The fluorescence was measured (excitation 570 nm, emiss...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/16/2007
Entry Details Article
PubMed