BDBM50227244 CHEMBL4096322

SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3ccccc3[n+]2[O-])cc1

InChI Key InChIKey=LKHXKCULVJOEHH-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 = 50227244   

TargetCarbonic anhydrase 2(Human)
Maastricht University Medical Centre

Curated by ChEMBL
LigandPNGBDBM50227244(CHEMBL4096322)
Affinity DataKi:  7.10nMAssay Description:Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Maastricht University Medical Centre

Curated by ChEMBL
LigandPNGBDBM50227244(CHEMBL4096322)
Affinity DataKi:  383nMAssay Description:Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Maastricht University Medical Centre

Curated by ChEMBL
LigandPNGBDBM50227244(CHEMBL4096322)
Affinity DataKi:  567nMAssay Description:Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2019
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
Maastricht University Medical Centre

Curated by ChEMBL
LigandPNGBDBM50227244(CHEMBL4096322)
Affinity DataKi:  1.46E+4nMAssay Description:Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2019
Entry Details Article
PubMed