BDBM50580268 CHEMBL5083451

SMILES CCO[C@@H]1O[C@H](CNC(=O)c2ccc(cc2)S(N)(=O)=O)[C@H](O)[C@H](O)[C@H]1O

InChI Key InChIKey=JRNQRHXJBOOOOV-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50580268   

TargetCarbonic anhydrase 2(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50580268(CHEMBL5083451)
Affinity DataIC50: 150nMAssay Description:Inhibition of recombinant human CA2 using 4-nitrophenylacetate as substrate by esterase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2023
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50580268(CHEMBL5083451)
Affinity DataIC50: 180nMAssay Description:Inhibition of recombinant human CA9 using 4-nitrophenylacetate as substrate by esterase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2023
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50580268(CHEMBL5083451)
Affinity DataIC50: 2.10E+3nMAssay Description:Inhibition of recombinant human CA1 using 4-nitrophenylacetate as substrate by esterase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2023
Entry Details Article
PubMed