Reaction Details Report a problem with these data
Target
Adenosine receptor A2b
Ligand
BDBM50573587
Substrate
n/a
Meas. Tech.
ChEMBL_2119774 (CHEMBL4828921)
Ki
3330±n/a nM
Citation
 Bednarska-Szczepaniak, K; Mieczkowski, A; Kierozalska, A; Pavlovi? Safti?, D; G??ba?a, K; Przygodzki, T; Sta?czyk, L; Karolczak, K; Wata?a, C; Rao, H; Gao, ZG; Jacobson, KA; Le?nikowski, ZJ Synthesis and evaluation of adenosine derivatives as A Eur J Med Chem 223:0 (2021) [PubMed]  Article 
Target
Name:
Adenosine receptor A2b
Synonyms:
AA2BR_HUMAN | ADENOSINE A2B | ADORA2B | Adenosine receptor A2B (A2B) | Adenosine receptors A2b | Adenosine receptors; A2a & A2b
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36341.22
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
332
Sequence:
MLLETQDALYVALELVIAALSVAGNVLVCAAVGTANTLQTPTNYFLVSLAAADVAVGLFAIPFAITISLGFCTDFYGCLFLACFVLVLTQSSIFSLLAVAVDRYLAICVPLRYKSLVTGTRARGVIAVLWVLAFGIGLTPFLGWNSKDSATNNCTEPWDGTTNESCCLVKCLFENVVPMSYMVYFNFFGCVLPPLLIMLVIYIKIFLVACRQLQRTELMDHSRTTLQREIHAAKSLAMIVGIFALCWLPVHAVNCVTLFQPAQGKNKPKWAMNMAILLSHANSVVNPIVYAYRNRDFRYTFHKIISRYLLCQADVKSGNGQAGVQPALGVGL
  
Inhibitor
Name:
BDBM50573587
Synonyms:
CHEMBL4861092
Type:
Small organic molecule
Emp. Form.:
C22H28N6O4
Mol. Mass.:
440.4955
SMILES:
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCCCCc3ccccc3)ncnc12 |r|
Structure:
Search PDB for entries with ligand similarity: