BDBM50023392 CHEMBL349519::{4-[3-(4-Amino-benzyl)-2,6-dioxo-1-propyl-2,3,6,9-tetrahydro-1H-purin-8-yl]-phenoxy}-acetic acid

SMILES CCCn1c(=O)n(Cc2ccc(N)cc2)c2nc([nH]c2c1=O)-c1ccc(OCC(O)=O)cc1

InChI Key InChIKey=JQFZHFFIHFBVEI-UHFFFAOYSA-N

Data  1 KI  2 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50023392   

TargetAdenosine receptor A1(Rat)
University of Virginia School of Medicine

Curated by ChEMBL
LigandPNGBDBM50023392({4-[3-(4-Amino-benzyl)-2,6-dioxo-1-propyl-2,3,6,9-...)
Affinity DataIC50: 3.40nMAssay Description:Binding affinity towards adenosine A1 receptor of rat brain membranes with 1 M NaCl by inhibition of [125-I]-labeled aminobenzyl adenosine binding More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/16/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Bovine)
University of Virginia School of Medicine

Curated by ChEMBL
LigandPNGBDBM50023392({4-[3-(4-Amino-benzyl)-2,6-dioxo-1-propyl-2,3,6,9-...)
Affinity DataKd:  32nMAssay Description:Displacement of [125-I]-labeled aminobenzyl adenosine binding to adenosine A1 receptor of bovine brain membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/16/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Virginia School of Medicine

Curated by ChEMBL
LigandPNGBDBM50023392({4-[3-(4-Amino-benzyl)-2,6-dioxo-1-propyl-2,3,6,9-...)
Affinity DataIC50: 64nMAssay Description:Binding affinity to adenosine A1 receptor of rat brain membranes without NaCl by inhibition of [125-I]-labeled aminobenzyl adenosine bindingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/16/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a/A2b(Human)
University of Virginia School of Medicine

Curated by ChEMBL
LigandPNGBDBM50023392({4-[3-(4-Amino-benzyl)-2,6-dioxo-1-propyl-2,3,6,9-...)
Affinity DataKi:  1.00E+3nMAssay Description:Inhibition of NECA binding to adenosine A2 receptor mediates reduced adenylate cyclase activity in human plateletsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/16/2012
Entry Details Article
PubMed