BDBM239155 7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-methylcoumarine (1a)

SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O

InChI Key InChIKey=DZSMNKZDRKEEQX-UHFFFAOYSA-N

Data  11 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 11 hits for monomerid = 239155   

TargetCarbonic anhydrase 9(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  370nM ΔG°:  -8.15kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5B, mitochondrial(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  380nM ΔG°:  -8.14kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed 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))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  390nM ΔG°:  -8.12kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  420nM ΔG°:  -8.08kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  460nM ΔG°:  -8.03kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5A, mitochondrial(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  840nM ΔG°:  -7.70kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 14(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Affinity DataKi:  930nM ΔG°:  -7.64kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
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 catalysed 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))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
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 catalysed 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))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
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 catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 13(Homo sapiens (Human))
Ecole Nationale Superieure De Chimie De Montpellier

LigandPNGBDBM239155(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
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 catalysed CO2 hydration activity. Phenol red (at a concentration of...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed