BDBM50612168 CHEMBL5268000

SMILES CCCOc1ccc2OC3(CCN(CC3)c3ccc(cc3[N+]([O-])=O)S(N)(=O)=O)CC(=O)c2c1

InChI Key InChIKey=JHHSEVNLVXISKA-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 = 50612168   

TargetCarbonic anhydrase 7(Human)
University of Kwazulu-Natal

Curated by ChEMBL
LigandPNGBDBM50612168(CHEMBL5268000)
Affinity DataKi:  76nMAssay 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
LigandPNGBDBM50612168(CHEMBL5268000)
Affinity DataKi:  291nMAssay 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
LigandPNGBDBM50612168(CHEMBL5268000)
Affinity DataKi:  1.24E+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
LigandPNGBDBM50612168(CHEMBL5268000)
Affinity DataKi:  8.69E+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