Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50051359
Substrate
n/a
Meas. Tech.
ChEMBL_31838 (CHEMBL641515)
Ki
5240±n/a nM
Citation
 Karton, Y; Jiang, JL; Ji, XD; Melman, N; Olah, ME; Stiles, GL; Jacobson, KA Synthesis and biological activities of flavonoid derivatives as A3 adenosine receptor antagonists. J Med Chem 39:2293-301 (1996) [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:
BDBM50051359
Synonyms:
3,6-Dichloro-2-(2,4,6-trimethyl-phenyl)-chromen-4-one | 3,6-dichloro-2-mesityl-4H-chromen-4-one | CHEMBL74248 | NSC-74931
Type:
Small organic molecule
Emp. Form.:
C18H14Cl2O2
Mol. Mass.:
333.209
SMILES:
Cc1cc(C)c(c(C)c1)-c1oc2ccc(Cl)cc2c(=O)c1Cl |(28.72,-16.12,;27.39,-16.88,;27.39,-18.42,;26.05,-19.19,;26.05,-20.73,;24.72,-18.42,;24.72,-16.88,;23.39,-16.11,;26.05,-16.11,;23.39,-19.18,;22.05,-18.4,;20.71,-19.17,;19.38,-18.41,;18.05,-19.18,;18.05,-20.72,;16.71,-21.49,;19.38,-21.5,;20.71,-20.72,;22.04,-21.49,;22.04,-23.03,;23.38,-20.72,;24.72,-21.5,)|
Structure:
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