BDBM50339077 (2R,3R,4S)-2-(6-amino-2-((E)-hex-1-enyl)-9H-purin-9-yl)tetrahydrothiophene-3,4-diol::CHEMBL1688379

SMILES CCCC\C=C\c1nc(N)c2ncn([C@@H]3SC[C@@H](O)[C@H]3O)c2n1

InChI Key InChIKey=UONIWMUCKYCQKH-GXDOZBQNSA-N

Data  3 KI  1 EC50

  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 4 hits for monomerid = 50339077   

TargetAdenosine receptor A3(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50339077((2R,3R,4S)-2-(6-amino-2-((E)-hex-1-enyl)-9H-purin-...)
Affinity DataKi:  13.2nMAssay Description:Displacement of [125I]I-AB-MECA from human adenosine A3 receptor expressed in CHO cells at 10 uMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50339077((2R,3R,4S)-2-(6-amino-2-((E)-hex-1-enyl)-9H-purin-...)
Affinity DataKi:  72nMAssay Description:Displacement of [3H]CGS21680 from human adenosine A2A receptor in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50339077((2R,3R,4S)-2-(6-amino-2-((E)-hex-1-enyl)-9H-purin-...)
Affinity DataKi:  72nMAssay Description:Displacement of [3H]CGS21680 from human adenosine A2A receptor expressed in HEK293 cells after 60 mins by gamma countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50339077((2R,3R,4S)-2-(6-amino-2-((E)-hex-1-enyl)-9H-purin-...)
Affinity DataEC50:  20.6nMAssay Description:Agonist activity at human recombinant adenosine A2A receptor expressed in CHO cells assessed as induction of cAMP production after 30 mins by immunoa...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed