BDBM50163858 CHEMBL2443188::carbonic anhydrase (CA) inhibitors, benzenesulphonamide ligand, 7

SMILES NS(=O)(=O)c1ccc(cc1Cl)C(=O)CSc1ncccn1

InChI Key InChIKey=ZQEDEEFNLDNUEW-UHFFFAOYSA-N

Data  36 Kd  18 Koff  12 Kon

PDB links: 4 PDB IDs match this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50163858   

TargetCarbonic anhydrase 6(Homo sapiens (Human))
Vilnius University

Curated by ChEMBL
LigandPNGBDBM50163858(CHEMBL2443188 | carbonic anhydrase (CA) inhibitors...)
Affinity DataKd:  2.50E+3nMAssay Description:Binding affinity to human recombinant carbonic anhydrase 6 expressed in Escherichia coli Rosetta2 (DE3) by thermal shift assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed