Reaction Details Report a problem with these data
Target
Adenosine receptor A1
Ligand
BDBM50080549
Substrate
n/a
Meas. Tech.
ChEMBL_28393 (CHEMBL636650)
EC50
32000±n/a nM
Citation
 van der Klein, PA; Kourounakis, AP; IJzerman, AP Allosteric modulation of the adenosine A(1) receptor. Synthesis and biological evaluation of novel 2-amino-3-benzoylthiophenes as allosteric enhancers of agonist binding. J Med Chem 42:3629-35 (1999) [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:
BDBM50080549
Synonyms:
CHEMBL123002 | [2-Amino-6-(3,4-dichloro-benzyl)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridin-3-yl]-(4-chloro-phenyl)-methanone
Type:
Small organic molecule
Emp. Form.:
C21H17Cl3N2OS
Mol. Mass.:
451.796
SMILES:
Nc1sc2CN(Cc3ccc(Cl)c(Cl)c3)CCc2c1C(=O)c1ccc(Cl)cc1
Structure:
Search PDB for entries with ligand similarity: