BDBM729528 US20250101019, Example 41

SMILES Cc1nc2c(C#N)ncc(-c3ccccc3)c2n1Cc1ccc(S(N)(=O)=O)cc1

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 2 hits for monomerid = 729528   

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Insilico Medicine IP

US Patent
LigandPNGBDBM729528(US20250101019, Example 41)
Affinity DataIC50: 0.5nMAssay Description:1. Diluted compounds in DMSO by hand for 11 points, 3 folds dilution. Then transferred 0.02 μL compounds to 384 assay plate by ECHO.2. Added 2 μL spe...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
7/31/2025
Entry Details
US Patent

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Insilico Medicine IP

US Patent
LigandPNGBDBM729528(US20250101019, Example 41)
Affinity DataIC50: 0.5nMAssay Description:1. Diluted compounds in DMSO by hand for 11 points, 3 folds dilution. Then transferred 0.02 μL compounds to 384 assay plate by ECHO.2. Added 2 μL spe...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
7/31/2025
Entry Details
US Patent