BDBM50180206 (2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin-9-yl)-3,4-dihydroxy-N-methyltetrahydrothiophene-2-carboxamide::2-chloro-N6-methyl-4'-thioadenosine-5'-methyluronamide::CHEMBL201706

SMILES CNC(=O)[C@H]1S[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC)nc(Cl)nc12

InChI Key InChIKey=KQEDWUPJFFHILG-QMWPFBOUSA-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 = 50180206   

TargetAdenosine receptor A3(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50180206((2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin...)
Affinity DataKi:  0.280nMAssay 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
LigandPNGBDBM50180206((2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin...)
Affinity DataKi:  0.280nMAssay Description:Binding affinity to human adenosine A3 receptorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A3(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50180206((2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin...)
Affinity DataKi:  0.280nMAssay Description:Displacement of [125I]AB-MECA from human adenosine A3 receptor transfected in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50180206((2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin...)
Affinity DataKi:  1.33E+3nMAssay Description:Displacement of [3H]R-PIA from human adenosine A1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50180206((2S,3S,4R,5R)-5-(2-chloro-6-(methylamino)-9H-purin...)
Affinity DataKi:  1.33E+3nMAssay Description:Displacement of [3H]R-PIA from human adenosine A1 receptor transfected in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed