BDBM50008386 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihydro-purine-2,6-dione::CHEMBL282038

SMILES Cn1cnc2n(C)c(=O)n(CC#C)c(=O)c12

InChI Key InChIKey=IORPOFJLSIHJOG-UHFFFAOYSA-N

Data  16 KI  2 IC50

  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 18 hits for monomerid = 50008386   

TargetAmine oxidase [flavin-containing] A(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human MAO-AMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAmine oxidase [flavin-containing] B(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human MAO-BMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  4.13E+3nMAssay Description:Displacement of [3H]PSB-603 from human adenosine A2B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  4.13E+3nMAssay Description:Binding affinity to human adenosine A2B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  4.13E+3nMAssay Description:Binding affinity at human Adenosine A2B receptor expressed in HEK293 cells, using [125I]ABOPX as radioligandMore 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
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  5.60E+3nMAssay Description:Displacement of [3H]MSX-2 from adenosine A2A receptor in rat brain striatumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  5.60E+3nMAssay Description:Binding affinity to rat adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Guinea pig)
TBA

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  6.00E+3nMAssay Description:Compound was evaluated for its ability to antagonise cyclic [3H]AMP accumulation in [3H]adenine-labeled guinea pig cerebral cortical slices.More 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
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  8.60E+3nMAssay Description:Ability to inhibit binding of [3H]-CGS- 21680 to adenosine A2A receptor in rat brain striatal membranes.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAdenosine receptor A3(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi: >1.00E+4nMAssay Description:Binding affinity to rat adenosine A3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]PSB-11 from human adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  1.10E+4nMAssay Description:Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortexMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  1.10E+4nMAssay Description:Binding affinity to rat adenosine A1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  1.20E+4nMAssay Description:Ability to inhibit binding of [3H]CHA to adenosine A1 receptor in rat brain cortical membranes.More 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
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  1.60E+4nMAssay Description:Ability to inhibit binding of [3H]NECA to Adenosine A2A receptor in rat brain striatal 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
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  2.20E+4nMAssay Description:Binding affinity for Adenosine A1 receptor using [3H]- CHA or [3H]- PIAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/23/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  4.50E+4nMAssay Description:Ability to inhibit binding of [3H]R-PIA to Adenosine A1 receptor in rat brain cortical 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
LigandPNGBDBM50008386(CHEMBL282038 | 3,7-Dimethyl-1-prop-2-ynyl-3,7-dihy...)
Affinity DataKi:  4.50E+4nMAssay Description:Ability to inhibit binding of 1 nM [3H]cyclohexyladenosine to adenosine A1 receptor in rat cerebral cortical membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed