BDBM50637433 CHEMBL5555730

SMILES CC(C)(O)[C@@H](O)COc1c2occc2cc2ccc(=O)oc12

InChI Key

  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 = 50637433   

TargetCarbonic anhydrase 9(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50637433(CHEMBL5555730)
Affinity DataKi:  28nMAssay Description:Inhibition of human CA IX incubated for 15 mins by stopped-flow instrument based assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCarbonic anhydrase 9(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50637433(CHEMBL5555730)
Affinity DataKi:  28nMAssay Description:Inhibition of human CA IX by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50637433(CHEMBL5555730)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human CA II incubated for 15 mins by stopped-flow instrument based assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetCarbonic anhydrase 2(Human)
University of South China

Curated by ChEMBL
LigandPNGBDBM50637433(CHEMBL5555730)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human CA II by stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed