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SMILES COc1cccc(c1)-c1nc(N)nc(-c2ccccc2)c1C#N

InChI Key

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50584556   

TargetAdenosine receptor A1(Homo sapiens (Human))TBA
LigandPNGBDBM50584556(CHEMBL5086406)copy SMILES
Affinity DataKi:  2.10nMAssay Description:Displacement of [3H]DPCPX from human A1AR expressed in CHO cell membrane incubated for 60 mins by microbeta trilux scintillation counter analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2M61Q5KPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))TBA
LigandPNGBDBM50584556(CHEMBL5086406)copy SMILES
Affinity DataKi:  6.90nMAssay Description:Displacement of [3H]HZ241385 from human A2AAR expressed in HeLa cell membrane incubated for 30 mins by microbeta trilux scintillation counter analysi...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2M61Q5KPubMed
TargetAdenosine receptor A2b(Homo sapiens (Human))TBA
LigandPNGBDBM50584556(CHEMBL5086406)copy SMILES
Affinity DataKi:  31nMAssay Description:Displacement of [3H]DPCPX from human A2BAR expressed in HEK293 cell membrane incubated for 30 mins by microbeta trilux scintillation counter analysisMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2M61Q5KPubMed