BDBM50665031 CHEMBL6172140

SMILES C[C@H]1[C@H](C)CC[C@]2(C(=O)Nc3ccccc3)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](OS(N)(=O)=O)[C@H](OS(N)(=O)=O)[C@@](C)(COS(N)(=O)=O)[C@@H]5CC[C@]43C)[C@H]12

InChI Key InChIKey=GRTZTIOAWUYGPD-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50665031   

TargetCarbonic anhydrase 9(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665031BDBM50665031(CHEMBL6172140)
Affinity DataKi:  26nMAssay Description:Binding affinity to human carbonic anhydrase 9 assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetCarbonic anhydrase 5A, mitochondrial(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665031BDBM50665031(CHEMBL6172140)
Affinity DataKi:  36nMAssay Description:Binding affinity to human carbonic anhydrase 5A assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665031BDBM50665031(CHEMBL6172140)
Affinity DataKi:  298nMAssay Description:Binding affinity to human carbonic anhydrase 2 assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed
TargetCarbonic anhydrase 1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50665031BDBM50665031(CHEMBL6172140)
Affinity DataKi:  5.23E+3nMAssay Description:Binding affinity to human carbonic anhydrase I assessed as inhibition constantMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed