BDBM50588869 CHEMBL5185944

SMILES NS(=O)(=O)c1ccc(NCC(=O)N\N=C2/C(=O)N(Cc3ccccc3)c3ccccc23)cc1

InChI Key InChIKey=VQTLMFWXGTZGQE-UHFFFAOYSA-N

Data  3 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50588869   

TargetCarbonic anhydrase 2(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50588869(CHEMBL5185944)
Affinity DataKi:  3nMAssay Description:Binding affinity to human recombinant CA2 assessed as inhibition constant incubated for 15 mins prior to testing by phenol red based stopped-flow CO2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCarbonic anhydrase 9(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50588869(CHEMBL5185944)
Affinity DataKi:  16nMAssay Description:Inhibition of human CA IX preincubated with compound for 15 mins by phenol red dye based stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCarbonic anhydrase 9(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50588869(CHEMBL5185944)
Affinity DataKi:  16nMAssay Description:Binding affinity to human recombinant CA9 assessed as inhibition constant incubated for 15 mins prior to testing by phenol red based stopped-flow CO2...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCarbonic anhydrase 12(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50588869(CHEMBL5185944)
Affinity DataKi:  34nMAssay Description:Binding affinity to human recombinant CA12 assessed as inhibition constant incubated for 15 mins prior to testing by phenol red based stopped-flow CO...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
Isf College of Pharmacy

Curated by ChEMBL
LigandPNGBDBM50588869(CHEMBL5185944)
Affinity DataKi:  204nMAssay Description:Inhibition of human CA II preincubated with compound for 15 mins by phenol red dye based stopped flow CO2 hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed