BDBM50034516 2-substituted NECA derivatives, 14::3-{4-[6-Amino-9-(5-ethylcarbamoyl-3,4-dihydroxy-tetrahydro-furan-2-yl)-9H-purin-2-ylethynyl]-phenyl}-propionic acid

SMILES CCNC(=O)C1OC(C(O)C1O)n1cnc2c(N)nc(nc12)C#Cc1ccc(CCC(O)=O)cc1

InChI Key InChIKey=GARQAYNTACVSPU-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 = 50034516   

TargetAdenosine receptor A3(Human)
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034516(3-{4-[6-Amino-9-(5-ethylcarbamoyl-3,4-dihydroxy-te...)
Affinity DataKi:  42nMMore 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
LigandPNGBDBM50034516(3-{4-[6-Amino-9-(5-ethylcarbamoyl-3,4-dihydroxy-te...)
Affinity DataKi:  1.00E+3nMMore 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
LigandPNGBDBM50034516(3-{4-[6-Amino-9-(5-ethylcarbamoyl-3,4-dihydroxy-te...)
Affinity DataKi:  2.20E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details Article
PubMed