BDBM12945 (1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl}-1H-1,2,3-triazol-4-yl)methyl 4-sulfamoylbenzoate::CHEMBL216245::Glycoconjugate Benzene Sulfonamide 3gg::Methyl 6-deoxy-6-(4-{4-sulfamoylbenzoyloxy}methyl-1H-1,2,3-triazol-1-yl)-alpha-D-glucopyranoside

SMILES CO[C@H]1O[C@H](Cn2cc(COC(=O)c3ccc(cc3)S(N)(=O)=O)nn2)[C@@H](O)[C@H](O)[C@H]1O

InChI Key InChIKey=XJNVWLJKVGJPEJ-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 12945   

TargetCarbonic anhydrase 12(Human)
Griffith University

Curated by ChEMBL
LigandPNGBDBM12945((1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyox...)
Affinity DataKi:  7.30nMAssay Description:Inhibition of human recombinant CA12 by CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Griffith University

LigandPNGBDBM12945((1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyox...)
Affinity DataKi:  8.60nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/7/2007
Entry Details Article
PubMed
TargetCarbonic anhydrase 14(Human)
Griffith University

Curated by ChEMBL
LigandPNGBDBM12945((1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyox...)
Affinity DataKi:  10.6nMAssay Description:Inhibition of human recombinant CA14 by CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Griffith University

LigandPNGBDBM12945((1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyox...)
Affinity DataKi:  67nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/7/2007
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Griffith University

LigandPNGBDBM12945((1-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyox...)
Affinity DataKi:  3.10E+3nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/7/2007
Entry Details Article
PubMed