BDBM50294665 (2R,3R,4R)-2-(6-(3-Bromobenzylamino)-9H-purin-9-yl)-tetrahydrofuran-3,4-diol::CHEMBL561855

SMILES O[C@@H]1CO[C@H]([C@@H]1O)n1cnc2c(NCc3cccc(Br)c3)ncnc12

InChI Key InChIKey=AMBOYCWPKZEJFM-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50294665   

TargetAdenosine receptor A3(Human)
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50294665((2R,3R,4R)-2-(6-(3-Bromobenzylamino)-9H-purin-9-yl...)
Affinity DataKi:  59nMAssay Description:Displacement of [3H]I-AB-MECA from human recombinant adenosine A3 receptor expressed in CHO cells by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50294665((2R,3R,4R)-2-(6-(3-Bromobenzylamino)-9H-purin-9-yl...)
Affinity DataKi:  1.06E+3nMAssay Description:Displacement of [3H]NECA from human recombinant adenosine A1 receptor expressed in CHO cells by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50294665((2R,3R,4R)-2-(6-(3-Bromobenzylamino)-9H-purin-9-yl...)
Affinity DataKi:  1.40E+3nMAssay Description:Displacement of [3H]CGS21680 from human recombinant adenosine A2a receptor expressed in HEK293 cells by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2010
Entry Details Article
PubMed