BDBM50300418 2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide::CHEMBL574809

SMILES CC(C)(C)n1c(=O)cc(Cl)s1=O

InChI Key InChIKey=XPUSAGLDGBTNOA-UHFFFAOYSA-N

Data  4 KI  1 IC50

  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 = 50300418   

TargetCarbonic anhydrase 12(Human)
University of Reims Champagne

Curated by ChEMBL
LigandPNGBDBM50300418(2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide ...)
Affinity DataKi:  54nMAssay Description:Inhibition of human carbonic anhydrase 12 assessed as inhibitory constant preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Reims Champagne

Curated by ChEMBL
LigandPNGBDBM50300418(2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide ...)
Affinity DataKi:  171nMAssay Description:Inhibition of human carbonic anhydrase 9 assessed as inhibitory constant preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Reims Champagne

Curated by ChEMBL
LigandPNGBDBM50300418(2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide ...)
Affinity DataKi:  454nMAssay Description:Inhibition of human carbonic anhydrase 1 assessed as inhibitory constant preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetHistone acetyltransferase KAT2B(Human)
University of Groningen

Curated by ChEMBL
LigandPNGBDBM50300418(2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide ...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant histone acetyltransferase PCAF assessed as CoA-SH activity preincubated for 15 mins by CPM fluorescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Reims Champagne

Curated by ChEMBL
LigandPNGBDBM50300418(2-Tert-butyl-5-chloroisothiazol-3(2H)-one 1-oxide ...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 2 assessed as inhibitory constant preincubated for 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed