BDBM248069 4-Methyl-2H-benzo[h]chromen-2-one (4)

SMILES Cc1cc(=O)oc2c1ccc1ccccc21

InChI Key InChIKey=UPMCEGGVPZVZHL-UHFFFAOYSA-N

Data  4 KI

  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 = 248069   

TargetCarbonic anhydrase 9(Homo sapiens (Human))
S.G.S.I.T.S.

LigandPNGBDBM248069(4-Methyl-2H-benzo[h]chromen-2-one (4))
Affinity DataKi:  230nM ΔG°:  -8.41kcal/molepH: 7.5 T: 2°CAssay Description:An applied photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
S.G.S.I.T.S.

LigandPNGBDBM248069(4-Methyl-2H-benzo[h]chromen-2-one (4))
Affinity DataKi:  5.50E+3nM ΔG°:  -6.67kcal/molepH: 7.5 T: 2°CAssay Description:An applied photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
S.G.S.I.T.S.

LigandPNGBDBM248069(4-Methyl-2H-benzo[h]chromen-2-one (4))
Affinity DataKi:  9.00E+3nM ΔG°:  -6.39kcal/molepH: 7.5 T: 2°CAssay Description:An applied photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
S.G.S.I.T.S.

LigandPNGBDBM248069(4-Methyl-2H-benzo[h]chromen-2-one (4))
Affinity DataKi: >2.00E+5nM ΔG°: >-4.69kcal/molepH: 7.5 T: 2°CAssay Description:An applied photophysics stopped-flow instrument has been used for assaying the CA catalyzed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed