BDBM50086171 4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetylamino}-benzamide::CHEMBL275360

SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)Nc2ccc(cc2)C(N)=O)cc1

InChI Key InChIKey=OOOUJHKGHPENGG-UHFFFAOYSA-N

Data  6 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50086171   

TargetAdenosine receptor A2b(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi:  7.80nMAssay Description:Antagonist activity against human A2B adenosine receptor expressed in HEK293 cells uisng [3H]ZM-241385 or [125I]-IABOPXMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi:  10nMAssay Description:Antagonist activity against adenosine A1 receptor in rat brain membrane in presence of [3H]R-PIA radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi:  39nMAssay Description:Antagonist activity against recombinant human adenosine A2A receptor expressed in HEK293 cells in presence of [125I]iodo-ZM-241385 radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi:  161nMAssay Description:Antagonist activity against recombinant human adenosine A1 receptor expressed in HEK293 cells in presence of [125I]IABA radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi:  683nMAssay Description:Antagonist activity against adenosine A2A receptor in rat striatal membrane in presence of [3H]CGS-21680 radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
National Institute of Diabetes

Curated by ChEMBL
LigandPNGBDBM50086171(4-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro...)
Affinity DataKi: >5.00E+3nMAssay Description:Antagonist activity against human adenosine A3 receptor expressed in HEK cells in presence of [125]IAB-MECA or [125I]IABA radioligand.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed