BDBM50636322 CHEMBL5542863

SMILES CCOc1cccc2cc(/C(C)=N/Nc3nc(-c4ccc(Cl)cc4)cs3)c(=O)oc12

InChI Key

  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 4 hits for monomerid = 50636322   

TargetCarbonic anhydrase 12(Human)
Tanta University

Curated by ChEMBL
LigandPNGBDBM50636322(CHEMBL5542863)
Affinity DataKi:  3.80E+3nMAssay Description:Inhibition of human CA12 preincubated for 6 hrs by phenol red staining based 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 9(Human)
Tanta University

Curated by ChEMBL
LigandPNGBDBM50636322(CHEMBL5542863)
Affinity DataKi:  6.10E+3nMAssay Description:Inhibition of human CA9 preincubated for 6 hrs by phenol red staining based 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)
Tanta University

Curated by ChEMBL
LigandPNGBDBM50636322(CHEMBL5542863)
Affinity DataKi:  9.77E+4nMAssay Description:Inhibition of human CA2 preincubated for 6 hrs by phenol red staining based 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 1(Human)
Tanta University

Curated by ChEMBL
LigandPNGBDBM50636322(CHEMBL5542863)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human CA1 preincubated for 6 hrs by phenol red staining based 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