null

SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCSC3)ncnc12

InChI Key InChIKey=HHCRBBSWADDJGK-BAYCTPFLSA-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 3 hits for monomerid = 50225885   

TargetAdenosine receptor A1(Homo sapiens (Human))
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50225885((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-((R)-tetrahyd...)copy SMILEScopy InChI
Affinity DataKi:  70nMAssay Description:Displacement of [3H]CPX from adenosine A1 receptor expressed in DDT1 MF2 cellsMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q24T6K64PubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50225885((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-((R)-tetrahyd...)copy SMILEScopy InChI
Affinity DataKi:  9.70E+3nMAssay Description:Displacement of [3H]ZM-241385 from adenosine A2A receptor expressed in PC12 cell membraneMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q24T6K64PubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50225885((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-((R)-tetrahyd...)copy SMILEScopy InChI
Affinity DataIC50: 5.30nMAssay Description:Agonist activity at adenosine A1 receptor expressed in DDT1 MF2 cells assessed as inhibition of (-)-isoproterenol-stimulated cAMP accumulationMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q24T6K64PubMed