Reaction Details Report a problem with these data
Target
Adenosine receptor A2a
Ligand
BDBM15336
Substrate
n/a
Meas. Tech.
ChEBML_27755
Ki
8000±n/a nM
Citation
 Daly, JW; Padgett, WL; Shamim, MT Analogues of caffeine and theophylline: effect of structural alterations on affinity at adenosine receptors. J Med Chem 29:1305-8 (1987) [PubMed]  Article 
Target
Name:
Adenosine receptor A2a
Synonyms:
AA2AR_CAVPO | ADENOSINE A2 | ADORA2A | Adenosine A2a receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
44955.08
Organism:
GUINEA PIG
Description:
ADENOSINE A2 0 GUINEA PIG::P46616
Residue:
409
Sequence:
MSSSVYITVELVIAVLAILGNVLVCWAVWINSNLQNVTNYFVVSLAAADIAVGVLAIPFAITISTGFCAACHGCLFFACFVLVLTQSSIFSLLTITIDRYIAIRIPLRYNGLVTCTRAKGIIAICWVLSFAIGLTPMLGWNNCSQPKGDKNHSESCDEGQVTCLFEDVVPMNYMVYYNFFAFVLVPLLLMLGIYLRIFLAARRQLKQMESQPLPGERTRSTLQKEVHPAKSLAIIVGLFALCCLPLNIINCFTFFCPECDHAPPWLMYLTIILSHGNSVVNPLIYAYRIREFRQTFRKIIRSHILRRRELFKAGGTSARASAAHSPEGEQVSLRLNGHPPGVWANGSALRPEQRPNGYVLGLVSGRSAQRSHGDASLSDVELLSHEHKGTCPESPSLEDPPAHGGAGVS
  
Inhibitor
Name:
BDBM15336
Synonyms:
1-methyl-3-(2-methylpropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione | 1-methyl-3-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione | 3-Isobutyl-1-methylxanthine | CHEMBL275084 | IBMX | isobutylmethylxanthine
Type:
Small organic molecule
Emp. Form.:
C10H14N4O2
Mol. Mass.:
222.2438
SMILES:
CC(C)Cn1c2nc[nH]c2c(=O)n(C)c1=O
Structure:
Search PDB for entries with ligand similarity: