BDBM771235 US12414952, Example 2.24

SMILES CC(C)n1nnc2c1CCN(CCc1nc3cc(-c4cccc(C#N)c4F)nc(N)n3n1)C2

InChI Key InChIKey=TWHXGCNJCVNQCO-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 = 771235   

TargetAdenosine receptor A2a(Human)
Merck Sharp & Dohme

US Patent
LigandChemical structure of BindingDB Monomer ID 771235BDBM771235(US12414952, Example 2.24)
Affinity DataIC50: 0.900nMMore 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 771235BDBM771235(US12414952, Example 2.24)
Affinity DataIC50: 73.6nMMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
12/28/2025
Entry Details
US Patent