BDBM50125569 CHEMBL3623631

SMILES CC1(C)CC(=O)C2=C(C1)N(C1=C(C2c2ccc(cc2)[N+]([O-])=O)C(=O)CC(C)(C)C1)c1ccc(cc1)S(N)(=O)=O

InChI Key InChIKey=XELJYZITRZHXDU-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 = 50125569   

TargetCarbonic anhydrase 12(Human)
Dumlupinar University

Curated by ChEMBL
LigandPNGBDBM50125569(CHEMBL3623631)
Affinity DataKi:  350nMAssay Description:Inhibition of recombinant human carbonic anhydrase 12 catalytic domain expressed in Escherichia coli incubated for 15 mins prior to testing by stoppe...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Dumlupinar University

Curated by ChEMBL
LigandPNGBDBM50125569(CHEMBL3623631)
Affinity DataKi:  640nMAssay Description:Inhibition of recombinant human carbonic anhydrase 2 expressed in Escherichia coli incubated for 15 mins prior to testing by stopped flow CO2 hydrase...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Dumlupinar University

Curated by ChEMBL
LigandPNGBDBM50125569(CHEMBL3623631)
Affinity DataKi:  1.02E+3nMAssay Description:Inhibition of recombinant human carbonic anhydrase 9 catalytic domain expressed in Escherichia coli incubated for 15 mins prior to testing by stopped...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2016
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Dumlupinar University

Curated by ChEMBL
LigandPNGBDBM50125569(CHEMBL3623631)
Affinity DataKi:  5.10E+3nMAssay Description:Inhibition of recombinant human carbonic anhydrase 1 expressed in Escherichia coli incubated for 15 mins prior to testing by stopped flow CO2 hydrase...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2016
Entry Details Article
PubMed