BDBM50219388 (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(1,1,3,3-tetramethylisoindolin-5-ylamino)-9H-purin-9-yl)-tetrahydrofuran-3,4-diol::CHEMBL249294

SMILES CC1(C)NC(C)(C)c2cc(Nc3ncnc4n(cnc34)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)ccc12

InChI Key InChIKey=NSHCGAYCUQOOPS-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50219388   

TargetAdenosine receptor A3(Human)
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50219388((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(1,1,3,3-tetr...)
Affinity DataKi:  280nMAssay Description:Binding affinity to adenosine A3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50219388((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(1,1,3,3-tetr...)
Affinity DataKi:  290nMAssay Description:Binding affinity to adenosine A1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50219388((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(1,1,3,3-tetr...)
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity to adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
Monash University (Parkville Campus)

Curated by ChEMBL
LigandPNGBDBM50219388((2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-(1,1,3,3-tetr...)
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity to adenosine A2B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed