BDBM551471 (R)-9-fluoro-8-methoxy-2-(1-(5-methyl-1-(tetrahydro- 2H-pyran-4-yl)-1H-pyrazol-4-yl)piperidin- 3-yl)-[1,2,4]triazolo[1,5-c]quinazoliu-5-amine::US11312719, Example 16

SMILES COc1cc2nc(N)n3nc(nc3c2cc1F)[C@@H]1CCCN(C1)c1cnn(C2CCOCC2)c1C

InChI Key InChIKey=QWPUTXDQVHOYKW-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 551471   

TargetAdenosine receptor A2a(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 551471BDBM551471((R)-9-fluoro-8-methoxy-2-(1-(5-methyl-1-(tetrahydr...)
Affinity DataIC50: 0.800nMAssay Description:148 μL (5 μg/mL) membranes (Perkin Elmer, Cat. No. RBHA2aM400UA) and 2 μL compounds of the invention to be tested (test compound) were...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2022
Entry Details
US Patent

TargetAdenosine receptor A2b(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 551471BDBM551471((R)-9-fluoro-8-methoxy-2-(1-(5-methyl-1-(tetrahydr...)
Affinity DataIC50: 426nMAssay Description:The reported affinity of the compounds of the invention for the human A2b adenosine receptor was determined experimentally using a radioligand filtra...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2022
Entry Details
US Patent