BDBM50144902 3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R)-2-(6-amino-purin-9-yl)-4-(3-1H-imidazol-4-yl-acryloyloxy)-5-((S)-(R)-methylsulfanylmethyl)-tetrahydro-furan-3-yl ester::CHEMBL72613

SMILES COC(=Cc1ccc(O)cc1)C(=O)O[C@@H]1[C@H](OC(=O)C=Cc2cnc[nH]2)[C@@H](CSC)O[C@H]1n1cnc2c(N)ncnc12

InChI Key InChIKey=YKXZBOLWPFOSEE-UHFFFAOYSA-N

Data  5 KI  3 IC50

  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 8 hits for monomerid = 50144902   

TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataKi:  3.26E+3nMAssay Description:Displacement of [3H]CCPA from Adenosine A1 receptor of rat cortical membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataIC50: 6.70E+3nMAssay Description:Inhibition of forskolin-stimulated cAMP accumulation in chinese hamster ovary cell membranes expressing human adenosine A3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataKi:  6.94E+3nMAssay 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:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataKi:  9.45E+3nMAssay Description:Displacement of [3H]DPCPX from rat Adenosine A1 receptor of cortical membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataKi: >1.00E+4nMAssay Description:Displacement of [3H]PSB-298 from human adenosine A2B receptor expressed in HEK293 cells at 10 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataKi:  1.71E+4nMAssay Description:Displacement of [3H]-MSX-2 from Adenosine A2A receptor of rat striatal membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataIC50: 2.30E+4nMAssay Description:Displacement of [3H]DPCPX from adenosine A1 receptor of rat cortical membranes without GTPMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Bonn

Curated by ChEMBL
LigandPNGBDBM50144902(3-(4-Hydroxy-phenyl)-2-methoxy-acrylic acid (3S,5R...)
Affinity DataIC50: 1.43E+5nMAssay Description:Displacement of [3H]DPCPX from adenosine A1 receptor of rat cortical membranes with GTPMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed