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Target
Adenosine receptor A1
Ligand
BDBM50555726
Substrate
n/a
Meas. Tech.
ChEMBL_2053441 (CHEMBL4708442)
Ki
283±n/a nM
Citation
 Ceni, C; Catarzi, D; Varano, F; Ben, DD; Marucci, G; Buccioni, M; Volpini, R; Angeli, A; Nocentini, A; Gratteri, P; Supuran, CT; Colotta, V Discovery of first-in-class multi-target adenosine A Eur J Med Chem 201:0 (2020) [PubMed]  Article 
Target
Name:
Adenosine receptor A1
Synonyms:
A1 adenosine receptor (hA1) | A1AR | AA1R_HUMAN | ADENOSINE A1 | ADORA1 | Adenosine A1 receptor (A1AR) | Adenosine A1-receptor | Adenosine receptor A1 (A1) | Adenosine receptor A1 (hA1) | Adenosine transporter (AdT)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36520.92
Organism:
Homo sapiens (Human)
Description:
P30542
Residue:
326
Sequence:
MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKMVVTPRRAAVAIAGCWILSFVVGLTPMFGWNNLSAVERAWAANGSMGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHKPSILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPIDEDLPEERPDD
  
Inhibitor
Name:
BDBM50555726
Synonyms:
CHEMBL4757832
Type:
Small organic molecule
Emp. Form.:
C27H27N7O4S
Mol. Mass.:
545.613
SMILES:
Nc1nc(cn2c1nn(-c1ccccc1)c2=O)-c1ccc(OCCNCCc2ccc(cc2)S(N)(=O)=O)cc1
Structure:
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