Reaction Details Report a problem with these data
Target
Adenosine receptor A1
Ligand
BDBM50377678
Substrate
n/a
Meas. Tech.
ChEMBL_479902 (CHEMBL935755)
Ki
1390±n/a nM
Citation
 Melman, A; Gao, ZG; Kumar, D; Wan, TC; Gizewski, E; Auchampach, JA; Jacobson, KA Design of (N)-methanocarba adenosine 5'-uronamides as species-independent A3 receptor-selective agonists. Bioorg Med Chem Lett 18:2813-9 (2008) [PubMed]  Article 
Target
Name:
Adenosine receptor A1
Synonyms:
AA1R_MOUSE | Adenosine A1 receptor | Adenosine receptor A1 | Adora1
Type:
PROTEIN
Mol. Mass.:
36646.06
Organism:
Mus musculus
Description:
ChEMBL_479902
Residue:
326
Sequence:
MPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSEVEQAWIANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIEEDIPEEKADD
  
Inhibitor
Name:
BDBM50377678
Synonyms:
CHEMBL258421
Type:
Small organic molecule
Emp. Form.:
C25H27ClN6O3
Mol. Mass.:
494.973
SMILES:
CCCC#Cc1nc(NCc2cccc(Cl)c2)c2ncn([C@@H]3[C@H]4C[C@]4([C@@H](O)[C@H]3O)C(=O)NC)c2n1
Structure:
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