BDBM50022106 CHEMBL3297803

SMILES CC1=NN2C=Nc3c(c(cn3-c3ccc(cc3)S(N)(=O)=O)-c3ccc(Br)cc3)C2=NC(=C1)c1ccccc1

InChI Key InChIKey=WDRUXIHVCWZQCM-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50022106   

TargetCarbonic anhydrase 12(Human)
King Saud University

Curated by ChEMBL
LigandPNGBDBM50022106(CHEMBL3297803)
Affinity DataKi:  3.40nMAssay 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
LigandPNGBDBM50022106(CHEMBL3297803)
Affinity DataKi:  3.60nMAssay 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
LigandPNGBDBM50022106(CHEMBL3297803)
Affinity DataKi:  7.10nMAssay 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
LigandPNGBDBM50022106(CHEMBL3297803)
Affinity DataKi:  28nMAssay 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