BDBM50534417 CHEMBL4458516

SMILES CC(=O)OC[C@H]1O[C@@H](NS(=O)(=O)c2ccc(O)cc2)C=C[C@H]1OC(C)=O

InChI Key InChIKey=OQMLCDBLTFXKNA-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 = 50534417   

TargetCarbonic anhydrase 2(Human)
Universidad Nacional De La Plata

Curated by ChEMBL
LigandPNGBDBM50534417(CHEMBL4458516)
Affinity DataKi:  137nMAssay Description:Inhibition of human carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Universidad Nacional De La Plata

Curated by ChEMBL
LigandPNGBDBM50534417(CHEMBL4458516)
Affinity DataKi:  3.84E+3nMAssay Description:Inhibition of human carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
Universidad Nacional De La Plata

Curated by ChEMBL
LigandPNGBDBM50534417(CHEMBL4458516)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 12 incubated for 15 mins prior to testing by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Universidad Nacional De La Plata

Curated by ChEMBL
LigandPNGBDBM50534417(CHEMBL4458516)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 9 incubated for 15 mins prior to testing by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/28/2021
Entry Details Article
PubMed