BDBM625941 US11786528, Comparative Example 1

SMILES COc1ccccc1Cn1cc2c(N)nc(nc2n1)-c1ccc(C)o1

InChI Key InChIKey=UWIGGHQCRFVLSZ-UHFFFAOYSA-N

Data  4 IC50

  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 4 hits for monomerid = 625941   

TargetAdenosine receptor A2a(Homo sapiens (Human))
Exscientia

US Patent
LigandPNGBDBM625941(US11786528, Comparative Example 1)
Affinity DataIC50:  2.20nMAssay Description:Affinity for the human adenosine receptor sub-types (A2a, A2b, A1 and A3) was determined by SPR as described in Aristotelous, T., et al, Methods in E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAdenosine receptor A3(Homo sapiens (Human))
Exscientia

US Patent
LigandPNGBDBM625941(US11786528, Comparative Example 1)
Affinity DataIC50:  1.97E+3nMAssay Description:Affinity for the human adenosine receptor sub-types (A2a, A2b, A1 and A3) was determined by SPR as described in Aristotelous, T., et al, Methods in E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAdenosine receptor A1(Homo sapiens (Human))
Exscientia

US Patent
LigandPNGBDBM625941(US11786528, Comparative Example 1)
Affinity DataIC50:  114nMAssay Description:Affinity for the human adenosine receptor sub-types (A2a, A2b, A1 and A3) was determined by SPR as described in Aristotelous, T., et al, Methods in E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetAlpha-2B adrenergic receptor(Homo sapiens (Human))
Exscientia

US Patent
LigandPNGBDBM625941(US11786528, Comparative Example 1)
Affinity DataIC50:  4.91E+3nMAssay Description:Affinity for the human adenosine receptor sub-types (A2a, A2b, A1 and A3) was determined by SPR as described in Aristotelous, T., et al, Methods in E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent