Reaction Details Report a problem with these data
Target
Adenosine receptor A3
Ligand
BDBM50561603
Substrate
n/a
Meas. Tech.
ChEMBL_2075496 (CHEMBL4731030)
Ki
2.8±n/a nM
Citation
 Tosh, DK; Salmaso, V; Rao, H; Campbell, R; Bitant, A; Gao, ZG; Auchampach, JA; Jacobson, KA Direct Comparison of (N)-Methanocarba and Ribose-Containing 2-Arylalkynyladenosine Derivatives as A ACS Med Chem Lett 11:1935-1941 (2020) [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:
BDBM50561603
Synonyms:
CHEMBL4764532
Type:
Small organic molecule
Emp. Form.:
C22H22FN5O3S
Mol. Mass.:
455.505
SMILES:
[H][C@]12C[C@]1([C@@H](O)[C@@H](O)[C@@H]2n1cnc2c(NCC)cc(nc12)C#Cc1ccc(F)s1)C(=O)NC |r|
Structure:
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