BDBM50022101 CHEMBL3298355

SMILES NC1=C(C=NN2C=Nc3c(c(cn3-c3ccc(cc3)S(N)(=O)=O)-c3ccc(Br)cc3)C2=N1)C#N

InChI Key InChIKey=AKEAGBYTGDLWNI-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 = 50022101   

TargetCarbonic anhydrase 12(Human)
King Saud University

Curated by ChEMBL
LigandPNGBDBM50022101(CHEMBL3298355)
Affinity DataKi:  0.900nMAssay Description:Inhibition of human recombinant carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
King Saud University

Curated by ChEMBL
LigandPNGBDBM50022101(CHEMBL3298355)
Affinity DataKi:  3.10nMAssay Description:Inhibition of human recombinant carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
King Saud University

Curated by ChEMBL
LigandPNGBDBM50022101(CHEMBL3298355)
Affinity DataKi:  5.20nMAssay Description:Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
King Saud University

Curated by ChEMBL
LigandPNGBDBM50022101(CHEMBL3298355)
Affinity DataKi:  80nMAssay Description:Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/12/2015
Entry Details Article
PubMed