BDBM50455116 CHEMBL2113540

SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(NS(=O)(=O)c4ccccn4)cc3)ncnc12

InChI Key InChIKey=IQVYUNJWQGINHQ-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 = 50455116   

TargetAdenosine receptor A3(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50455116(CHEMBL2113540)
Affinity DataKi:  54nMAssay Description:Binding affinity against rat adenosine A3 receptor expressed in CHO cells using [125I]-.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50455116(CHEMBL2113540)
Affinity DataKi:  292nMAssay Description:Binding affinity against adenosine A1 receptor in rat brain membranes using [3H]R-PIA.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Rat)
University of Ferrara

Curated by ChEMBL
LigandPNGBDBM50455116(CHEMBL2113540)
Affinity DataKi:  740nMAssay Description:Binding affinity against adenosine A2A receptor in rat striatal membranes using [3H]-CGS- 21680.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/8/2012
Entry Details Article
PubMed