BDBM50034536 2-substituted NECA derivatives, 13::5-[6-Amino-2-(4-carbamoyl-phenylethynyl)-purin-9-yl]-3,4-dihydroxy-tetrahydro-furan-2-carboxylic acid ethylamide::5-{6-amino-2-[2-(4-carbamoylphenyl)ethynyl]-9H-purin-9-yl}-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide

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

InChI Key InChIKey=SODZZEVQQQTQCC-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 = 50034536   

TargetAdenosine receptor A3(Human)
Universitat Wurzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034536(5-{6-amino-2-[2-(4-carbamoylphenyl)ethynyl]-9H-pur...)
Affinity DataKi:  9.30nMMore 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
LigandPNGBDBM50034536(5-{6-amino-2-[2-(4-carbamoylphenyl)ethynyl]-9H-pur...)
Affinity DataKi:  200nMMore 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
LigandPNGBDBM50034536(5-{6-amino-2-[2-(4-carbamoylphenyl)ethynyl]-9H-pur...)
Affinity DataKi:  470nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details Article
PubMed