Reaction Details | |||
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Target | Adenosine receptor A1 | ||
Ligand | BDBM50581950 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_2152676 (CHEMBL5037223) | ||
Ki | 0.600000±n/a nM | ||
Citation | Trinh, PNH; Chong, DJW; Leach, K; Hill, SJ; Tyndall, JDA; May, LT; Vernall, AJ; Gregory, KJ Development of Covalent, Clickable Probes for Adenosine A J Med Chem64:8161-8178 (2021) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Adenosine receptor A1 | |||
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: |
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BDBM50581950 | |||
n/a | |||
Name | BDBM50581950 | ||
Synonyms: | CHEMBL4204703 | ||
Type | Small organic molecule | ||
Emp. Form. | C18H20N4O | ||
Mol. Mass. | 308.3776 | ||
SMILES | O[C@H]1CC[C@@H](CC1)Nc1nc(nc2[nH]ccc12)-c1ccccc1 |r,wU:4.7,wD:1.0,(5.09,-4.45,;6.42,-5.22,;6.43,-6.76,;7.77,-7.53,;9.09,-6.74,;9.09,-5.21,;7.76,-4.45,;10.43,-7.5,;10.44,-9.04,;9.12,-9.82,;9.13,-11.35,;10.47,-12.12,;11.8,-11.34,;13.26,-11.81,;14.16,-10.57,;13.25,-9.33,;11.79,-9.81,;7.8,-12.13,;6.47,-11.36,;5.14,-12.13,;5.14,-13.68,;6.47,-14.45,;7.81,-13.68,)| | ||
Structure |