BDBM50661716 CHEMBL6169052

SMILES COc1cccc2c(N3CCC(O)(CCNS(N)(=O)=O)CC3)ncnc12

InChI Key InChIKey=OLQGMQCOPIRVSK-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50661716   

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Shanghai Jiao Tong University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661716BDBM50661716(CHEMBL6169052)
Affinity DataIC50: 154nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details PubMed
TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Shanghai Jiao Tong University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661716BDBM50661716(CHEMBL6169052)
Affinity DataIC50: 305nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
6/5/2026
Entry Details PubMed