Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM50085668
Substrate
n/a
Meas. Tech.
ChEBML_31973
Ki
0.100000±n/a nM
Citation
Keeling, SE; Albinson, FD; Ayres, BE; Butchers, PR; Chambers, CL; Cherry, PC; Ellis, F; Ewan, GB; Gregson, M; Knight, J; Mills, K; Ravenscroft, P; Reynolds, LH; Sanjar, S; Sheehan, MJ The discovery and synthesis of highly potent, A2a receptor agonists. Bioorg Med Chem Lett 10:403-6 (2000) [PubMed] Article
More Info.:
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:
BDBM50085668
Synonyms:
(2S,3S,4R,5R)-5-[6-Amino-2-((1R,2R)-2-hydroxy-cyclopentylamino)-purin-9-yl]-3,4-dihydroxy-tetrahydro-furan-2-carboxylic acid ethylamide | CHEMBL130830
Type:
Small organic molecule
Emp. Form.:
C17H25N7O5
Mol. Mass.:
407.4243
SMILES:
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)nc(N[C@@H]3CCC[C@H]3O)nc12