BDBM511099 2-benzyl-2-(((2R,3S,4R,5R)-5-(5-chloro-7-(isopropylamino)-3H-imidazo[4,5-b]pyridin-3-yl)-3-ethynyl-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)malonic acid & 2-benzyl-2-(((2R,3S,4R,5R)-5-(2-chloro-6-(dimethylamino)-9H-purin-9-yl)-3-ethynyl-3,4-dihydroxytetrahydrofuran-2-yl)methoxy)malonic acid::US11078228, Example 30

SMILES CC(C)Nc1cc(Cl)nc2n(cnc12)[C@@H]1O[C@H](COC(Cc2ccccc2)(C(O)=O)C(O)=O)[C@](O)(C#C)[C@H]1O

InChI Key InChIKey=XAMQFGYFSACDFJ-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 511099   

Target5'-nucleotidase(Human)
Calithera Biosciences

Curated by ChEMBL
LigandPNGBDBM511099(2-benzyl-2-(((2R,3S,4R,5R)-5-(5-chloro-7-(isopropy...)
Affinity DataIC50: 2nMAssay Description:Inhibition of human CA1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed
Target5'-nucleotidase(Human)
Calithera Biosciences

Curated by ChEMBL
LigandPNGBDBM511099(2-benzyl-2-(((2R,3S,4R,5R)-5-(5-chloro-7-(isopropy...)
Affinity DataIC50: 5nMAssay Description:For measurements of soluble CD73 enzyme activity, recombinant CD73 was obtained from R&D Systems, Cat. No. 5795-EN-010. Serial dilutions of test comp...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/16/2022
Entry Details
US Patent

Target5'-nucleotidase(Human)
Calithera Biosciences

Curated by ChEMBL
LigandPNGBDBM511099(2-benzyl-2-(((2R,3S,4R,5R)-5-(5-chloro-7-(isopropy...)
Affinity DataIC50: 160nMAssay Description:Inhibition of CD73 in human plasma incubated for 15 mins in presence of 15N5-AMP by LC/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/13/2024
Entry Details
PubMed