BDBM50637503 CHEMBL4442992

SMILES Cc1cc(=O)oc2cc(OCc3cn(CCCCCCCCCCOc4ccc5ccc(=O)oc5c4)nn3)ccc12

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 = 50637503   

TargetCarbonic anhydrase 12(Human)
Tribhuvan University

Curated by ChEMBL
LigandPNGBDBM50637503(CHEMBL4442992)
Affinity DataKi:  72nMAssay Description:Binding affinity to human CA12 assessed as inhibition constant incubated for 6 hrs by phenol red dye based stopped flow CO2 hydration 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)
Tribhuvan University

Curated by ChEMBL
LigandPNGBDBM50637503(CHEMBL4442992)
Affinity DataKi:  161nMAssay Description:Binding affinity to human CA9 assessed as inhibition constant incubated for 6 hrs by phenol red dye based stopped flow CO2 hydration 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)
Tribhuvan University

Curated by ChEMBL
LigandPNGBDBM50637503(CHEMBL4442992)
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity to human CA2 assessed as inhibition constant incubated for 6 hrs by phenol red dye based stopped flow CO2 hydration 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)
Tribhuvan University

Curated by ChEMBL
LigandPNGBDBM50637503(CHEMBL4442992)
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity to human CA1 assessed as inhibition constant incubated for 6 hrs by phenol red dye based stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed