null

SMILES CNc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)-n1cc(cn1)-c1ccccn1

InChI Key InChIKey=QNEMXBBBHJLADK-SCFUHWHPSA-N

  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 5 hits for monomerid = 50196564   

TargetAdenosine receptor A3(Homo sapiens (Human))
Universit£ di Ferrara

Curated by ChEMBL
LigandPNGBDBM50196564((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(methylamino)...)copy SMILEScopy InChI
Affinity DataKi:  2nMAssay Description:Displacement of [125I]I-AB-MECA from human recombinant adenosine A3 receptor expressed in CHO cells after 60 mins by gamma counterMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25H7HDKPubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
Universit£ di Ferrara

Curated by ChEMBL
LigandPNGBDBM50196564((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(methylamino)...)copy SMILEScopy InChI
Affinity DataKi:  2nMAssay Description:Displacement of [125I]ABMECA from adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KK9BDPPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
CV Therapeutics Inc.

Curated by ChEMBL
LigandPNGBDBM50196564((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(methylamino)...)copy SMILEScopy InChI
Affinity DataKi:  3.80E+3nMAssay Description:Displacement of [3H]CPX from adenosine A1 receptor in DDT membranesMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KK9BDPPubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
CV Therapeutics Inc.

Curated by ChEMBL
LigandPNGBDBM50196564((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(methylamino)...)copy SMILEScopy InChI
Affinity DataKi:  3.80E+3nMAssay Description:Displacement of [3H]CCPA from human recombinant adenosine A1 receptor expressed in CHO cells after 60 mins by gamma counterMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25H7HDKPubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universit£ di Ferrara

Curated by ChEMBL
LigandPNGBDBM50196564((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(methylamino)...)copy SMILEScopy InChI
Affinity DataKi: >5.00E+3nMAssay Description:Displacement of [3H]CGS21680 from human recombinant adenosine A2A receptor expressed in CHO cells after 60 mins by gamma counterMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q25H7HDKPubMed