BDBM50179035 (2S,3S,4R,5R)-5-(6-{bis[(5-chloropyridin-2-yl)carbamoyl]amino}-9H-purin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide::CHEMBL202249

SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(ncnc12)N(C(=O)Nc1ccc(Cl)cn1)C(=O)Nc1ccc(Cl)cn1

InChI Key InChIKey=LJGLCROUFKPYMM-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 50179035   

TargetAdenosine receptor A1(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50179035((2S,3S,4R,5R)-5-(6-{bis[(5-chloropyridin-2-yl)carb...)
Affinity DataKi:  761nMAssay Description:Binding affinity against adenosine A1 receptor in rat brain membranes using [3H]R-PIA.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50179035((2S,3S,4R,5R)-5-(6-{bis[(5-chloropyridin-2-yl)carb...)
Affinity DataKi:  799nMAssay Description:Binding affinity against adenosine A2A receptor in rat striatal membranes using [3H]-CGS- 21680.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50179035((2S,3S,4R,5R)-5-(6-{bis[(5-chloropyridin-2-yl)carb...)
Affinity DataKi:  5.70E+3nMAssay Description:Binding affinity against rat adenosine A3 receptor expressed in CHO cells using [125I]-.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50179035((2S,3S,4R,5R)-5-(6-{bis[(5-chloropyridin-2-yl)carb...)
Affinity DataKi:  5.70E+3nMAssay Description:Displacement of [125I]AB-MECA from rat adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed