BDBM50377500 CHEMBL260718

SMILES OC[C@@H]1CCCN1c1nc(-c2nccs2)c2sccc2n1

InChI Key InChIKey=DFJYJKJUDWOECT-UHFFFAOYSA-N

Data  4 KI  1 EC50

  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 5 hits for monomerid = 50377500   

TargetAdenosine receptor A2a(Human)
Vernalis (R&D)

Curated by ChEMBL
LigandPNGBDBM50377500(CHEMBL260718)
Affinity DataKi:  2.80nMAssay Description:Binding affinity at human adenosine A2A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Vernalis (R&D)

Curated by ChEMBL
LigandPNGBDBM50377500(CHEMBL260718)
Affinity DataKi:  14nMAssay Description:Binding affinity at human adenosine A1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
Vernalis (R&D)

Curated by ChEMBL
LigandPNGBDBM50377500(CHEMBL260718)
Affinity DataKi:  456nMAssay Description:Binding affinity at human adenosine A3 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
Vernalis (R&D)

Curated by ChEMBL
LigandPNGBDBM50377500(CHEMBL260718)
Affinity DataKi:  2.48E+3nMAssay Description:Binding affinity at human adenosine A2B receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
Vernalis (R&D)

Curated by ChEMBL
LigandPNGBDBM50377500(CHEMBL260718)
Affinity DataEC50: >1.00E+4nMAssay Description:Agonist activity at human recombinant adenosine A2A receptor expressed in CHO cells assessed as calcium mobilization by FLIPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed