BDBM50034531 5-(6-Amino-2-phenylethynyl-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-carboxylic acid ethylamide::5-[6-amino-2-(2-phenylethynyl)-9H-purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide::9, PENECA

SMILES CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccccc1

InChI Key InChIKey=SWXXHYTUMIMRFO-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 = 50034531   

TargetAdenosine receptor A3(Homo sapiens (Human))
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034531(5-(6-Amino-2-phenylethynyl-purin-9-yl)-3,4-dihydro...)
Affinity DataKi:  6.20nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A1(Homo sapiens (Human))
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034531(5-(6-Amino-2-phenylethynyl-purin-9-yl)-3,4-dihydro...)
Affinity DataKi:  560nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetAdenosine receptor A2a(Homo sapiens (Human))
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034531(5-(6-Amino-2-phenylethynyl-purin-9-yl)-3,4-dihydro...)
Affinity DataKi:  620nMMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed