Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM549533
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
IC50
3.80±n/a nM
Citation
 Pham, SM; Kankanala, J; Jadhavar, PS; Mulik, BM; Khan, F; Ramachandran, SA Heterocyclic compounds as adenosine antagonists US Patent  US11306071 Publication Date 4/19/2022 
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:
BDBM549533
Synonyms:
US11306071, Compound 109
Type:
Small organic molecule
Emp. Form.:
C28H21N7O
Mol. Mass.:
471.5126
SMILES:
C[C@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(nc1N)-c1cccc(c1)C#N)c1ccccn1 |r|
Structure:
Search PDB for entries with ligand similarity: