BDBM50018013 4-Bromomethyl-N-(2-{2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetylamino}-ethyl)-benzamide::CHEMBL9725

SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCCNC(=O)c2ccc(CBr)cc2)cc1

InChI Key InChIKey=MFMZGNCIFQTXIZ-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50018013   

TargetAdenosine receptor A1(Bovine)
Niddk

Curated by ChEMBL
LigandPNGBDBM50018013(CHEMBL9725 | 4-Bromomethyl-N-(2-{2-[4-(2,6-dioxo-1...)
Affinity DataKi:  10nMAssay Description:Affinity for Adenosine A1 receptor using [125I]APNEA in calf brain.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rat)
Niddk

Curated by ChEMBL
LigandPNGBDBM50018013(CHEMBL9725 | 4-Bromomethyl-N-(2-{2-[4-(2,6-dioxo-1...)
Affinity DataKi:  12nMAssay Description:Affinity for adenosine A1 receptor using [3H]N6-(phenylisopropyl)adenosine (R)-[3H]-PIA as a radioligand in rat brain.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2012
Entry Details Article
PubMed