BDBM205477 PPiase inhibitor, 21

SMILES Cc1cc(C)cc(c1)-n1cccc1-c1nc(nc(n1)N1CCCCCC1)N1CCCCCC1

InChI Key InChIKey=QEASZOUOJFTMJL-UHFFFAOYSA-N

Data  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 = 205477   

TargetInorganic pyrophosphatase(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
University of Kentucky

LigandPNGBDBM205477(PPiase inhibitor, 21)
Affinity DataIC50: 1.66E+5nMpH: 7.5 T: 2°CAssay Description:The compounds were first mixed with tetrasodium PPi (final concentration of 100 μM) at concentrations specified in the text in the reaction buff...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2016
Entry Details Article
PubMed
TargetInorganic pyrophosphatase(Escherichia coli (strain K12))
University of Kentucky

LigandPNGBDBM205477(PPiase inhibitor, 21)
Affinity DataIC50: 4.92E+5nMpH: 7.5 T: 2°CAssay Description:The compounds were first mixed with tetrasodium PPi (final concentration of 100 μM) at concentrations specified in the text in the reaction buff...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2016
Entry Details Article
PubMed
TargetInorganic pyrophosphatase(Baker's yeast)
University of Kentucky

LigandPNGBDBM205477(PPiase inhibitor, 21)
Affinity DataIC50: 6.00E+5nMpH: 7.5 T: 2°CAssay Description:The compounds were first mixed with tetrasodium PPi (final concentration of 100 μM) at concentrations specified in the text in the reaction buff...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2016
Entry Details Article
PubMed
TargetProbable manganese-dependent inorganic pyrophosphatase(Staphylococcus aureus (strain MRSA252))
University of Kentucky

LigandPNGBDBM205477(PPiase inhibitor, 21)
Affinity DataIC50: 3.00E+5nMpH: 7.5 T: 2°CAssay Description:The compounds were first mixed with tetrasodium PPi (final concentration of 100 μM) at concentrations specified in the text in the reaction buff...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2016
Entry Details Article
PubMed