BDBM656987 US20240076297, Example 4.8

SMILES COc1cccc2c3nc(COCc4csc5ccccc45)nn3c(N)nc12

InChI Key InChIKey=JEGFSBVZTODQSU-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 656987   

TargetAdenosine receptor A2a(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM656987(US20240076297, Example 4.8)
Affinity DataIC50: 2.90nMAssay Description:Method (B): Binding affinity using SPA was conducted as follows. Test compounds (50 nL) were dispensed into individual wells of a 384-well OptiPlate&...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/22/2024
Entry Details
Go to US Patent