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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Beta-1 adrenergic receptor | ||
| Ligand | BDBM50160821 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_909576 (CHEMBL3059446) | ||
| EC50 | 36±n/a nM | ||
| Citation |  Senthil Kumar, P; Bharatam, PV Comparative 3D QSAR study on ?(1)-, ?(2)-, and ?(3)-adrenoceptor agonists. Med Chem Res19:1121-1140 (2010) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Beta-1 adrenergic receptor | |||
| Name: | Beta-1 adrenergic receptor | ||
| Synonyms: | ADRB1 | ADRB1R | ADRB1_HUMAN | B1AR | Beta-1 adrenoceptor | Beta-1 adrenoreceptor | adrenergic Beta1 | ||
| Type: | G Protein-Coupled Receptor (GPCR) | ||
| Mol. Mass.: | 51338.40 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P08588 | ||
| Residue: | 477 | ||
| Sequence: |
| ||
| BDBM50160821 | |||
| n/a | |||
| Name | BDBM50160821 | ||
| Synonyms: | CHEMBL182770 | Methanesulfonic acid 3-((R)-2-{(R)-2-hydroxy-2-[3-(3-methyl-but-2-enylamino)-phenyl]-ethylamino}-propyl)-1H-indol-7-yl ester | ||
| Type | Small organic molecule | ||
| Emp. Form. | C25H33N3O4S | ||
| Mol. Mass. | 471.612 | ||
| SMILES | C[C@H](Cc1c[nH]c2c(OS(C)(=O)=O)cccc12)NC[C@H](O)c1cccc(NCC=C(C)C)c1 |wU:19.21,1.0,(1.08,-.52,;1.1,1.02,;2.42,1.8,;3.76,1.02,;3.76,-.52,;5.08,-1.3,;6.43,-.52,;7.75,-1.28,;7.72,-2.83,;9.06,-3.6,;10.38,-2.83,;9.06,-5.15,;7.72,-4.37,;9.08,-.52,;9.08,1.02,;7.75,1.77,;6.43,1.02,;-.24,1.8,;-1.56,1.02,;-2.9,1.77,;-2.92,3.32,;-4.24,1,;-4.24,-.55,;-5.58,-1.32,;-6.92,-.55,;-6.92,1,;-8.24,1.77,;-9.58,1,;-10.9,1.76,;-12.23,.98,;-13.57,1.75,;-12.23,-.56,;-5.58,1.77,)| | ||
| Structure | 
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