BDBM50184624 6-(2-methoxyphenyl)-2,4,6-trioxohexanoic acid::CHEMBL2070205::CHEMBL208806

SMILES COc1ccccc1C(=O)CC(=O)CC(=O)C(O)=O

InChI Key InChIKey=LQXNNELHXFSXQV-UHFFFAOYSA-N

Data  4 KI  1 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 5 hits for monomerid = 50184624   

TargetCarbonic anhydrase 9(Human)
University of Sassari

Curated by ChEMBL
LigandPNGBDBM50184624(CHEMBL2070205 | CHEMBL208806 | 6-(2-methoxyphenyl)...)
Affinity DataKi:  720nMAssay Description:Inhibition of human CA9 using CO2 as substrate incubated for 6 hrs prior to substrate addition measured for 10 to 100 secs by stopped flow techniqueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Sassari

Curated by ChEMBL
LigandPNGBDBM50184624(CHEMBL2070205 | CHEMBL208806 | 6-(2-methoxyphenyl)...)
Affinity DataKi:  770nMAssay Description:Inhibition of human CA12 using CO2 as substrate incubated for 6 hrs prior to substrate addition measured for 10 to 100 secs by stopped flow techniqueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed
TargetIntegrase(Human immunodeficiency virus type 1)
Bristol-Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50184624(CHEMBL2070205 | CHEMBL208806 | 6-(2-methoxyphenyl)...)
Affinity DataIC50: 4.00E+3nMAssay Description:Inhibition of HIV1 recombinant integraseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/7/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Sassari

Curated by ChEMBL
LigandPNGBDBM50184624(CHEMBL2070205 | CHEMBL208806 | 6-(2-methoxyphenyl)...)
Affinity DataKi:  4.02E+3nMAssay Description:Inhibition of human CA1 using CO2 as substrate incubated for 6 hrs prior to substrate addition measured for 10 to 100 secs by stopped flow techniqueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Sassari

Curated by ChEMBL
LigandPNGBDBM50184624(CHEMBL2070205 | CHEMBL208806 | 6-(2-methoxyphenyl)...)
Affinity DataKi:  4.35E+3nMAssay Description:Inhibition of human CA2 using CO2 as substrate incubated for 6 hrs prior to substrate addition measured for 10 to 100 secs by stopped flow techniqueMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/8/2013
Entry Details Article
PubMed