BDBM50233595 CHEMBL4082617

SMILES COc1cc(C[C@@H]2C[C@H]2C(O)=O)c(Br)c(Br)c1OC

InChI Key InChIKey=YKKJXISLEKOFOH-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 = 50233595   

TargetCarbonic anhydrase 1(Human)
Ataturk University

Curated by ChEMBL
LigandPNGBDBM50233595(CHEMBL4082617)
Affinity DataKi:  3.40nMAssay Description:Inhibition of human CA1 using para-nitrophenylacetate as substrate measured over 3 mins by UV-vis spectrophotometric methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Ataturk University

Curated by ChEMBL
LigandPNGBDBM50233595(CHEMBL4082617)
Affinity DataKi:  7.30nMAssay Description:Inhibition of human CA2 using para-nitrophenylacetate as substrate measured over 3 mins by UV-vis spectrophotometric methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Ataturk University

Curated by ChEMBL
LigandPNGBDBM50233595(CHEMBL4082617)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human CA9 by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
Ataturk University

Curated by ChEMBL
LigandPNGBDBM50233595(CHEMBL4082617)
Affinity DataKi: >5.00E+4nMAssay Description:Inhibition of human CA12 by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/4/2019
Entry Details Article
PubMed