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Target
Adenosine receptor A1
Ligand
BDBM50588463
Substrate
n/a
Meas. Tech.
ChEMBL_2187177 (CHEMBL5099259)
EC50
0.524807±n/a nM
Citation
 Preti, B; Suchankova, A; Deganutti, G; Leuenberger, M; Barkan, K; Manulak, I; Huang, X; Carvalho, S; Ladds, G; Lochner, M Discovery and Structure-Activity Relationship Studies of Novel Adenosine A J Med Chem 65:14864-14890 (2022) [PubMed] 
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:
BDBM50588463
Synonyms:
CHEMBL5174429
Type:
Small organic molecule
Emp. Form.:
C23H27ClN6O5
Mol. Mass.:
502.951
SMILES:
CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N[C@@H]3CCC[C@H]3Oc3cccc(Cl)c3)ncnc12 |r|
Structure:
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