BDBM50139870 4-(1-Butyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-benzenesulfonic acid::CHEMBL268617

SMILES CCCCn1c(=O)[nH]c2nc([nH]c2c1=O)-c1ccc(cc1)S(O)(=O)=O

InChI Key InChIKey=PCKXZNBJTANMBU-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50139870   

TargetAdenosine receptor A2b(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50139870(4-(1-Butyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8...)
Affinity DataKi:  70nMAssay Description:Binding affinity for human adenosine A2B receptor using [3H]ZM-241385 in CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50139870(4-(1-Butyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8...)
Affinity DataKi:  475nMAssay Description:Displacement of [3H]-CCPA from adenosine A1 receptor of rat brain cortical membrane preparationsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50139870(4-(1-Butyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8...)
Affinity DataKi:  8.07E+3nMAssay Description:Displacement of [3H]MSX-2 from adenosine A2A receptor of rat brain striatal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed