Target
Adenosine receptor A1
Ligand
BDBM50271538
Substrate
n/a
Meas. Tech.
ChEMBL_556460 (CHEMBL955677)
Ki
4.6±n/a nM
Citation
 Colotta, VCatarzi, DVarano, FLenzi, OFilacchioni, GMartini, CTrincavelli, LCiampi, OTraini, CPugliese, AMPedata, FMorizzo, EMoro, S Synthesis, ligand-receptor modeling studies and pharmacological evaluation of novel 4-modified-2-aryl-1,2,4-triazolo[4,3-a]quinoxalin-1-one derivatives as potent and selective human A3 adenosine receptor antagonists. Bioorg Med Chem 16:6086-102 (2008) [PubMed]  Article 
Target
Name:
Adenosine receptor A1
Synonyms:
AA1R_BOVIN | ADENOSINE A1 | ADENOSINE A1 high | ADENOSINE A1 low | ADORA1 | Adenosine A1 receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
36602.99
Organism:
BOVINE
Description:
ADENOSINE 0 BOVINE::P28190
Residue:
326
Sequence:
MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPRTYFHTCLKVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAVVAITGCWILSFVVGLTPMFGWNNLSAVERDWLANGSVGEPVIECQFEKVISMEYMVYFNFFVWVLPPLLLMVLIYMEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHMPRILIYIAIFLSHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPVDEDAPAERPDD
  
Inhibitor
Name:
BDBM50271538
Synonyms:
4-benzylureido-1,2-dihydro-6-nitro-2-phenyl-1,2,4-triazolo[4,3-a]quinoxalin-1-one | CHEMBL484313
Type:
Small organic molecule
Emp. Form.:
C23H17N7O4
Mol. Mass.:
455.4256
SMILES:
[O-][N+](=O)c1cccc2c1nc(NC(=O)NCc1ccccc1)c1nn(-c3ccccc3)c(=O)n21
Structure:
Search PDB for entries with ligand similarity: