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Attributes

UniProt ID
Protein Name
Adenosine receptor A2a
Ligand Name
8-[(~{E})-2-(3,4-dimethoxyphenyl)ethenyl]-1,3-diethyl-7-methyl-purine-2,6-dione
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IQVRBWUUXZMOPW-PKNBQFBNSA-N
SMILES
CCN1c2c(n(c(n2)C=Cc3ccc(c(c3)OC)OC)C)C(=O)N(C1=O)CC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 8GNG
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Color Legend
Unassigned regionsLigand / hetero atomse8gngA1e8gngH1e8gngH2e8gngL1e8gngL2e8gngX1e8gngY1e8gngY2e8gngZ1e8gngZ2
ECOD domains from experimental PDB structures interacting with ligand DB11757
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P29274DB11757JQ98gnge8gngA1A:2-309
P29274DB11757JQ98gnge8gngX1X:5-312