BDBM50214980 (2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-purin-9-yl)tetrahydrothiophene-3,4-diol::CHEMBL227279

SMILES O[C@@H]1CS[C@H]([C@@H]1O)n1cnc2c(NCc3ccccc3Cl)nc(Cl)nc12

InChI Key InChIKey=XUIYCLQDMOOVSQ-IXPVHAAZSA-N

Data  5 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50214980   

TargetPeroxisome proliferator-activated receptor delta(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50214980((2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-...)
Affinity DataKi:  0.620nMAssay Description:Displacement of Fluormone-Pan-PPAR Green from human GST-tagged PPARdelta LBD by TR-FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50214980((2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-...)
Affinity DataKi:  25.8nMAssay Description:Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50214980((2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-...)
Affinity DataKi:  26nMAssay Description:Displacement of [125I]I-AB-MECA from human A3 adenosine receptor expressed in CHO cell membranes after 60 mins by gamma counting methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50214980((2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-...)
Affinity DataKi:  1.60E+3nMAssay Description:Displacement of [3H]CGS21680 from human A2A adenosine receptor expressed in HEK293 cell membranes after 60 mins by gamma counting methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50214980((2R,3R,4S)-2-(2-chloro-6-(2-chlorobenzylamino)-9H-...)
Affinity DataKi:  1.60E+3nMAssay Description:Displacement of [3H]CGS21680 from human adenosine A2A receptor expressed in HEK293 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed