BDBM771212 US12414952, Example 1.17

SMILES Cc4c(c1ncco1)nc(N)n5nc(CCN2CCc3c(C2)nnn3CC(F)(F)F)nc45

InChI Key InChIKey=SWSGRPDYIMTZRJ-UHFFFAOYSA-N

  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 = 771212   

TargetAdenosine receptor A2a(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 771212BDBM771212(US12414952, Example 1.17)
Affinity DataIC50: 1.30nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
12/28/2025
Entry Details
US Patent

TargetAdenosine receptor A2b(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 771212BDBM771212(US12414952, Example 1.17)
Affinity DataIC50: 35.2nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
12/28/2025
Entry Details
US Patent