BDBM50582926 CHEMBL5093072

SMILES COc1ccc(OC)c(c1)-c1nc(SCC(=O)c2ccccc2)nc(Nc2cccc(c2)S(N)(=O)=O)c1C#N

InChI Key InChIKey=ARCWTHGUJWBEQN-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 = 50582926   

TargetCarbonic anhydrase 12(Human)
National Research Centre

Curated by ChEMBL
LigandPNGBDBM50582926(CHEMBL5093072)
Affinity DataKi:  157nMAssay Description:Inhibition of human CA12 preincubated for 15 mins by phenol red dye based stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
National Research Centre

Curated by ChEMBL
LigandPNGBDBM50582926(CHEMBL5093072)
Affinity DataKi:  5.05E+3nMAssay Description:Inhibition of human CA9 preincubated for 15 mins by phenol red dye based stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
National Research Centre

Curated by ChEMBL
LigandPNGBDBM50582926(CHEMBL5093072)
Affinity DataKi:  8.34E+3nMAssay Description:Inhibition of human CA1 preincubated for 15 mins by phenol red dye based stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
National Research Centre

Curated by ChEMBL
LigandPNGBDBM50582926(CHEMBL5093072)
Affinity DataKi: >2.00E+4nMAssay Description:Inhibition of human CA2 preincubated for 15 mins by phenol red dye based stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/6/2023
Entry Details Article
PubMed