BDBM191054 US9181253, 114

SMILES O[C@H]1[C@@H](O)C[C@@]2(n3cnc4c(NC5CC6CCC5C6)nc(Cl)nc43)C[C@@H]12

InChI Key InChIKey=CXBQRTGJJCJHGX-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 191054   

TargetAdenosine receptor A1(Human)
Department Of Health And Human Services

US Patent
LigandChemical structure of BindingDB Monomer ID 191054BDBM191054(US9181253, 114)
Affinity DataKi:  200nM ΔG°:  -9.13kcal/molepH: 7.5 T: 2°CAssay Description:Radioligand binding assays at A1, A2A, and A3ARs were performed according to the procedures described previously. Each tube in the binding assay cont...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2016
Entry Details
US Patent

TargetAdenosine receptor A3 [I248L](Human)
Department Of Health And Human Services

US Patent
LigandChemical structure of BindingDB Monomer ID 191054BDBM191054(US9181253, 114)
Affinity DataKi:  236nM ΔG°:  -9.03kcal/molepH: 7.5 T: 2°CAssay Description:Radioligand binding assays at A1, A2A, and A3ARs were performed according to the procedures described previously. Each tube in the binding assay cont...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2016
Entry Details
US Patent

TargetAdenosine receptor A2a(Human)
Department Of Health And Human Services

US Patent
LigandChemical structure of BindingDB Monomer ID 191054BDBM191054(US9181253, 114)
Affinity DataKi:  4.08E+3nM ΔG°:  -7.35kcal/molepH: 7.5 T: 2°CAssay Description:Radioligand binding assays at A1, A2A, and A3ARs were performed according to the procedures described previously. Each tube in the binding assay cont...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2016
Entry Details
US Patent