Reaction Details Report a problem with these data
Target
Adenosine receptor A1
Ligand
BDBM50438370
Substrate
n/a
Meas. Tech.
ChEMBL_976686 (CHEMBL2417092)
Ki
1.6±n/a nM
Citation
 Kozma, E; Jayasekara, PS; Squarcialupi, L; Paoletta, S; Moro, S; Federico, S; Spalluto, G; Jacobson, KA Fluorescent ligands for adenosine receptors. Bioorg Med Chem Lett 23:26-36 (2012) [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:
BDBM50438370
Synonyms:
CHEMBL2413101
Type:
Small organic molecule
Emp. Form.:
C34H33N11O9
Mol. Mass.:
739.6941
SMILES:
OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CC(=O)Nc4ccc(CC(=O)NCCNc5ccc([N+]([O-])=O)c6nonc56)cc4)cc3)ncnc12 |r|
Structure:
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