BDBM50304635 9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranosyl)-N6-(3-iodo-benzyl)adenine::CHEMBL596042

SMILES CCNC(=O)[C@H]1S[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)ncnc12

InChI Key InChIKey=XROLQKSRXCUQAD-QCUYGVNKSA-N

Data  7 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 7 hits for monomerid = 50304635   

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

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  0.420nMAssay 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
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  0.420nMAssay 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
TargetPeroxisome proliferator-activated receptor delta(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  3.20nMAssay 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 A1(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  5.40nMAssay Description:Displacement of [3H]CCPA from human A1 receptor expressed in CHO cell membranes after 60 mins by gamma counting methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Sahmyook University

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  5.40nMAssay 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 A2a(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  57.6nMAssay Description:Displacement of [3H]CGS21680 from human adenosine A2A receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Ewha Womans University

Curated by ChEMBL
LigandPNGBDBM50304635(9-(5'-Ethylaminocarbonyl-4-thio-beta-D-ribofuranos...)
Affinity DataKi:  58nMAssay 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