BDBM519634 US11142524, Compound 107::sodium 5-(2-((6-cyano-7-methyl-3H-

SMILES COc1ccc(NC(=O)CSc2nc3c(C)c(ncc3[nH]2)C#N)cc1OP([O-])([O-])=O

InChI Key InChIKey=DMHQWLLNQRPYGU-UHFFFAOYSA-L

Data  2 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 2 hits for monomerid = 519634   

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Stingray Therapeutics

US Patent
LigandPNGBDBM519634(sodium 5-(2-((6-cyano-7-methyl-3H- | US11142524, C...)
Affinity DataIC50: 116nMAssay Description:MaterialsAssay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0. Substrate: 100 μM Adenosine 5′-triphosphate disodium salt hydrate (Pr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2022
Entry Details
US Patent

TargetEctonucleotide pyrophosphatase/phosphodiesterase family member 1(Human)
Stingray Therapeutics

US Patent
LigandPNGBDBM519634(sodium 5-(2-((6-cyano-7-methyl-3H- | US11142524, C...)
Affinity DataIC50: 231nMAssay Description:Materials:Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma:...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/4/2022
Entry Details
US Patent