Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50140961
Substrate
n/a
Meas. Tech.
ChEMBL_31836 (CHEMBL641338)
Ki
>1000±n/a nM
Citation
 Baraldi, PG; Tabrizi, MA; Preti, D; Bovero, A; Romagnoli, R; Fruttarolo, F; Zaid, NA; Moorman, AR; Varani, K; Gessi, S; Merighi, S; Borea, PA Design, synthesis, and biological evaluation of new 8-heterocyclic xanthine derivatives as highly potent and selective human A2B adenosine receptor antagonists. J Med Chem 47:1434-47 (2004) [PubMed]  Article 
Target
Name:
Adenosine receptor A3
Synonyms:
A3 adenosine receptor (hA3) | AA3R_HUMAN | ADORA3 | Adenosine A3 receptor (A3AR)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36197.32
Organism:
Homo sapiens (Human)
Description:
P0DMS8
Residue:
318
Sequence:
MPNNSTALSLANVTYITMEIFIGLCAIVGNVLVICVVKLNPSLQTTTFYFIVSLALADIAVGVLVMPLAIVVSLGITIHFYSCLFMTCLLLIFTHASIMSLLAIAVDRYLRVKLTVRYKRVTTHRRIWLALGLCWLVSFLVGLTPMFGWNMKLTSEYHRNVTFLSCQFVSVMRMDYMVYFSFLTWIFIPLVVMCAIYLDIFYIIRNKLSLNLSNSKETGAFYGREFKTAKSLFLVLFLFALSWLPLSIINCIIYFNGEVPQLVLYMGILLSHANSMMNPIVYAYKIKKFKETYLLILKACVVCHPSDSLDTSIEKNSE
  
Inhibitor
Name:
BDBM50140961
Synonyms:
8-{2-Methyl-5-[2-(4-methyl-piperazin-1-yl)-2-oxo-ethoxy]-2H-pyrazol-3-yl}-1,3-dipropyl-3,7-dihydro-purine-2,6-dione | CHEMBL286838
Type:
Small organic molecule
Emp. Form.:
C22H32N8O4
Mol. Mass.:
472.5407
SMILES:
CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1cc(OCC(=O)N2CCN(C)CC2)nn1C
Structure:
Search PDB for entries with ligand similarity: