BDBM50041894 2-substituted NECA derivatives, 12::5-(6-Amino-2-cyclohex-1-enylethynyl-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-carboxylic acid ethylamide

SMILES CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#CC1=CCCCC1

InChI Key InChIKey=DJOLZUMDTLSSJV-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 = 50041894   

TargetAdenosine receptor A3(Human)
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50041894(5-(6-Amino-2-cyclohex-1-enylethynyl-purin-9-yl)-3,...)
Affinity DataKi:  28nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50041894(5-(6-Amino-2-cyclohex-1-enylethynyl-purin-9-yl)-3,...)
Affinity DataKi:  87nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50041894(5-(6-Amino-2-cyclohex-1-enylethynyl-purin-9-yl)-3,...)
Affinity DataKi:  100nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details Article
PubMed