Reaction Details Report a problem with these data
Target
Adenosine receptor A1
Ligand
BDBM50367871
Substrate
n/a
Meas. Tech.
ChEBML_28977
Ki
2±n/a nM
Citation
 Jacobson, KA; Barone, S; Kammula, U; Stiles, GL Electrophilic derivatives of purines as irreversible inhibitors of A1 adenosine receptors. J Med Chem 32:1043-51 (1989) [PubMed]  Article 
Target
Name:
Adenosine receptor A1
Synonyms:
AA1R_RAT | ADENOSINE A1 | ADENOSINE A1 high | ADENOSINE A1 low | Adenosine A1 receptor (A1) | Adenosine receptor | Adenosine receptors A1 | Adora1
Type:
Protein
Mol. Mass.:
36704.13
Organism:
Rattus norvegicus (rat)
Description:
n/a
Residue:
326
Sequence:
MPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED
  
Inhibitor
Name:
BDBM50367871
Synonyms:
CHEMBL605179
Type:
Small organic molecule
Emp. Form.:
C35H36N10O8S
Mol. Mass.:
756.788
SMILES:
OCC1OC(C(O)C1O)n1cnc2c(Nc3ccc(CC(=O)Nc4ccc(CC(=O)NCC[N-]C(=[SH+])Nc5ccc(cc5)[N+]([O-])=O)cc4)cc3)ncnc12
Structure:
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