BDBM50205709 (2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol::(3R,4S,5R)-2-((R)-6-amino-2-phenylethynyl-9H-purin-3-yl)-5-hydroxymethyl-tetrahydro-furan-3,4-diol::CHEMBL375190

SMILES Nc1nc(nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C#Cc1ccccc1

InChI Key InChIKey=BARJSNBJYYNDDG-UHFFFAOYSA-N

Data  11 KI

  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 11 hits for monomerid = 50205709   

TargetAdenosine receptor A3(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  16nMAssay Description:Binding affinity to human adenosine A3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  16nMAssay Description:Displacement of [3H]NECA from human recombinant adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  42nMAssay Description:Displacement of [3H]NECA from human adenosine A3 receptor expressed in HeLa cell membrane incubated for 180 mins by microplate beta scintillation cou...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetAdenosine receptor A2a/A2b(Rat)
Yamasa Shoyu

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  109nMAssay Description:Inhibition of [3H]NECA binding to adenosine A2 receptor from rat striatal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/22/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  363nMAssay Description:Binding affinity to human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  363nMAssay Description:Displacement of [3H]NECA from human recombinant adenosine A2A receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  391nMAssay Description:Binding affinity to human adenosine A1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  391nMAssay Description:Displacement of [3H]CCPA from human recombinant adenosine A1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  646nMAssay Description:Displacement [3H]DPCPX from human adenosine A1 receptor expressed in CHO cell membrane incubated for 60 mins by microplate beta scintillation countin...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
Yamasa Shoyu

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  701nMAssay Description:Inhibition of [3H]CHA binding to adenosine A1 receptor from rat brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/22/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
University of Camerino

Curated by ChEMBL
LigandPNGBDBM50205709((2R,3R,4S,5R)-2-(6-amino-2-(phenylethynyl)-9H-puri...)
Affinity DataKi:  1.04E+3nMAssay Description:Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in HeLa cell membrane incubated for 30 mins by microplate beta scintillation...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/23/2022
Entry Details Article
PubMed