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SMILES [H][C@@]12C[C@]1([H])[C@H]([C@H](O)[C@@H]2O)n1cnc2c(NCCc3ccc(OC)c(OC)c3)nc(nc12)C#Cc1ccccc1

InChI Key InChIKey=FMAIBXIIXFYTSJ-ROUKPJICSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50527832   

TargetAdenosine receptor A3(Homo sapiens (Human))
Medical College of Wisconsin

Curated by ChEMBL
LigandPNGBDBM50527832(CHEMBL4453175)copy SMILEScopy InChI
Affinity DataKi:  16nMAssay Description:Displacement of [125I]I-AB-MECA from recombinant human A3AR expressed in HEK293 cell membranes measured after 60 mins by liquid scintillation countin...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JS9TWHPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Medical College of Wisconsin

Curated by ChEMBL
LigandPNGBDBM50527832(CHEMBL4453175)copy SMILEScopy InChI
Affinity DataKi:  208nMAssay Description:Displacement of [3H]R-PIA from recombinant human A1AR expressed in HEK293 cell membranes measured after 60 mins by liquid scintillation counting meth...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JS9TWHPubMed
TargetAdenosine receptor A3(Mus musculus)
Medical College of Wisconsin

Curated by ChEMBL
LigandPNGBDBM50527832(CHEMBL4453175)copy SMILEScopy InChI
Affinity DataKi:  331nMAssay Description:Displacement of [125I]I-AB-MECA from recombinant mouse A3AR expressed in HEK293 cell membranes measured after 60 mins by liquid scintillation countin...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2JS9TWHPubMed