Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50385943
Substrate
n/a
Meas. Tech.
ChEMBL_824765 (CHEMBL2044692)
IC50
141±n/a nM
Citation
 Hausler, NE; Devine, SM; McRobb, FM; Warfe, L; Pouton, CW; Haynes, JM; Bottle, SE; White, PJ; Scammells, PJ Synthesis and pharmacological evaluation of dual acting antioxidant A(2A) adenosine receptor agonists. J Med Chem 55:3521-34 (2012) [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:
BDBM50385943
Synonyms:
CHEMBL2042299
Type:
Small organic molecule
Emp. Form.:
C20H26N8O4
Mol. Mass.:
442.4716
SMILES:
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(NCCc3ccc(N)cc3)nc12 |r|
Structure:
Search PDB for entries with ligand similarity: