Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM50309495
Substrate
n/a
Meas. Tech.
ChEMBL_609496 (CHEMBL1071768)
Ki
48±n/a nM
Citation
 Beattie, D; Brearley, A; Brown, Z; Charlton, SJ; Cox, B; Fairhurst, RA; Fozard, JR; Gedeck, P; Kirkham, P; Meja, K; Nanson, L; Neef, J; Oakman, H; Spooner, G; Taylor, RJ; Turner, RJ; West, R; Woodward, H Synthesis and evaluation of two series of 4'-aza-carbocyclic nucleosides as adenosine A2A receptor agonists. Bioorg Med Chem Lett 20:1219-24 (2010) [PubMed]  Article 
Target
Name:
Adenosine receptor A2a
Synonyms:
A2A adenosine receptor (hA2A) | AA2AR_HUMAN | ADENOSINE A2 | ADENOSINE A2a | ADORA2 | ADORA2A | Adenosine A2A receptor (A2AAR)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
44716.46
Organism:
Homo sapiens (Human)
Description:
P29274
Residue:
412
Sequence:
MPIMGSSVYITVELAIAVLAILGNVLVCWAVWLNSNLQNVTNYFVVSLAAADIAVGVLAIPFAITISTGFCAACHGCLFIACFVLVLTQSSIFSLLAIAIDRYIAIRIPLRYNGLVTGTRAKGIIAICWVLSFAIGLTPMLGWNNCGQPKEGKNHSQGCGEGQVACLFEDVVPMNYMVYFNFFACVLVPLLLMLGVYLRIFLAARRQLKQMESQPLPGERARSTLQKEVHAAKSLAIIVGLFALCWLPLHIINCFTFFCPDCSHAPLWLMYLAIVLSHTNSVVNPFIYAYRIREFRQTFRKIIRSHVLRQQEPFKAAGTSARVLAAHGSDGEQVSLRLNGHPPGVWANGSAPHPERRPNGYALGLVSGGSAQESQGNTGLPDVELLSHELKGVCPEPPGLDDPLAQDGAGVS
  
Inhibitor
Name:
BDBM50309495
Synonyms:
(2S,3S,4R,5R)-2-(4-ethyl-1H-1,2,3-triazol-1-yl)-5-(2-(2-(1-ethyl-1H-imidazol-4-yl)ethylamino)-6-(2-ethylbutylamino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol | CHEMBL599566
Type:
Small organic molecule
Emp. Form.:
C27H41N11O2
Mol. Mass.:
551.6869
SMILES:
CCC(CC)CNc1nc(NCCc2cn(CC)cn2)nc2n(cnc12)[C@@H]1C[C@@H]([C@@H](O)[C@H]1O)n1cc(CC)nn1 |r|
Structure:
Search PDB for entries with ligand similarity: