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Target
Adenosine receptor A3
Ligand
BDBM50454913
Substrate
n/a
Meas. Tech.
ChEMBL_30324 (CHEMBL638578)
Ki
191±n/a nM
Citation
 Moro, S; van Rhee, AM; Sanders, LH; Jacobson, KA Flavonoid derivatives as adenosine receptor antagonists: a comparison of the hypothetical receptor binding site based on a comparative molecular field analysis model. J Med Chem 41:46-52 (1998) [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:
BDBM50454913
Synonyms:
CHEMBL147110
Type:
Small organic molecule
Emp. Form.:
C20H19ClO3
Mol. Mass.:
342.816
SMILES:
CCOc1c(oc2ccc(Cl)cc2c1=O)-c1c(C)cc(C)cc1C |(10.5,-2.04,;9.17,-2.81,;9.17,-4.35,;7.85,-5.13,;7.85,-6.68,;6.51,-7.45,;5.18,-6.68,;3.86,-7.45,;2.53,-6.7,;2.5,-5.16,;1.15,-4.39,;3.85,-4.37,;5.18,-5.14,;6.49,-4.36,;6.49,-2.82,;9.18,-7.45,;9.18,-8.99,;7.84,-9.76,;10.51,-9.75,;11.84,-8.98,;13.17,-9.74,;11.84,-7.43,;10.51,-6.67,;10.48,-5.13,)|
Structure:
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