BDBM50612152 CHEMBL5279810

SMILES NS(=O)(=O)c1ccc(N2CCC3(CC2)CC(=O)c2cc(OCCO)ccc2O3)c(c1)[N+]([O-])=O

InChI Key InChIKey=LUGSQNZOCSCMMA-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50612152   

TargetCarbonic anhydrase 7(Human)
University of Kwazulu-Natal

Curated by ChEMBL
LigandPNGBDBM50612152(CHEMBL5279810)
Affinity DataKi:  1.5nMAssay Description:Binding affinity to human CA7 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
University of Kwazulu-Natal

Curated by ChEMBL
LigandPNGBDBM50612152(CHEMBL5279810)
Affinity DataKi:  52nMAssay Description:Binding affinity to human CA2 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed
TargetCarbonic anhydrase 9(Human)
University of Kwazulu-Natal

Curated by ChEMBL
LigandPNGBDBM50612152(CHEMBL5279810)
Affinity DataKi:  3.75E+3nMAssay Description:Binding affinity to human CA9 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed
TargetCarbonic anhydrase 1(Human)
University of Kwazulu-Natal

Curated by ChEMBL
LigandPNGBDBM50612152(CHEMBL5279810)
Affinity DataKi:  8.05E+3nMAssay Description:Binding affinity to human CA1 assessed as inhibition constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed