Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM50202777
Substrate
n/a
Meas. Tech.
ChEMBL_454055 (CHEMBL903246)
Ki
0.3±n/a nM
Citation
 Silverman, LS; Caldwell, JP; Greenlee, WJ; Kiselgof, E; Matasi, JJ; Tulshian, DB; Arik, L; Foster, C; Bertorelli, R; Monopoli, A; Ongini, E 3H-[1,2,4]-Triazolo[5,1-i]purin-5-amine derivatives as adenosine A2A antagonists. Bioorg Med Chem Lett 17:1659-62 (2007) [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:
BDBM50202777
Synonyms:
3-(2-(4-(4-chloro-2-fluorophenyl)piperazin-1-yl)ethyl)-8-(furan-2-yl)-3H-[1,2,4]triazolo[1,5-g]purin-5-amine | CHEMBL246055
Type:
Small organic molecule
Emp. Form.:
C22H21ClFN9O
Mol. Mass.:
481.913
SMILES:
Nc1nc2n(CCN3CCN(CC3)c3ccc(Cl)cc3F)cnc2c2nc(nn12)-c1ccco1
Structure:
Search PDB for entries with ligand similarity: