Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM50563135
Substrate
n/a
Meas. Tech.
ChEMBL_2081575 (CHEMBL4737366)
Ki
9.4±n/a nM
Citation
 Renk, DR; Skraban, M; Bier, D; Schulze, A; Wabbals, E; Wedekind, F; Neumaier, F; Neumaier, B; Holschbach, M Design, synthesis and biological evaluation of Tozadenant analogues as adenosine A Eur J Med Chem 214:0 (2021) [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:
BDBM50563135
Synonyms:
CHEMBL4745912
Type:
Small organic molecule
Emp. Form.:
C20H27FN4O4S
Mol. Mass.:
438.516
SMILES:
COc1ccc(N2CCOCC2)c2sc(NC(=O)N3CCC(O)(CCF)CC3)nc12
Structure:
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