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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Neuronal acetylcholine receptor subunit alpha-4/beta-2 | ||
| Ligand | BDBM50534295 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1928134 (CHEMBL4431206) | ||
| Ki | 6392±n/a nM | ||
| Citation |  Sarasamkan, J; Scheunemann, M; Apaijai, N; Palee, S; Parichatikanond, W; Arunrungvichian, K; Fischer, S; Chattipakorn, S; Deuther-Conrad, W; Schüürmann, G; Brust, P; Vajragupta, O Varying Chirality Across Nicotinic Acetylcholine Receptor Subtypes: Selective Binding of Quinuclidine Triazole Compounds. ACS Med Chem Lett7:890-895 (2016) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Neuronal acetylcholine receptor subunit alpha-4/beta-2 | |||
| Name: | Neuronal acetylcholine receptor subunit alpha-4/beta-2 | ||
| Synonyms: | Neuronal acetylcholine receptor Alpha-4/Beta-2 | Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit | Neuronal acetylcholine receptor; alpha4/beta2 | nAChR subtypes alpha4 beta2 | ||
| Type: | Protein | ||
| Mol. Mass.: | n/a | ||
| Description: | n/a | ||
| Components: | This complex has 2 components. | ||
| Component 1 | |||
| Name: | Neuronal acetylcholine receptor subunit alpha-4 | ||
| Synonyms: | ACHA4_HUMAN | CHRNA4 | CHRNA4 protein | NACRA4 | Neuronal acetylcholine receptor protein alpha-4 subunit | Neuronal acetylcholine receptor subunit alpha 4 beta 2 | Nicotinic acetylcholine receptor alpha4/beta2/alpha5 | ||
| Type: | n/a | ||
| Mol. Mass.: | 69963.49 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | NACHRA4 | ||
| Residue: | 627 | ||
| Sequence: |
| ||
| Component 2 | |||
| Name: | Neuronal acetylcholine receptor subunit beta-2 | ||
| Synonyms: | ACHB2_HUMAN | CHRNB2 | Neuronal acetylcholine receptor protein beta-2 subunit | Nicotinic acetylcholine receptor alpha3/beta2/alpha5 | ||
| Type: | Protein | ||
| Mol. Mass.: | 57020.50 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P17787 | ||
| Residue: | 502 | ||
| Sequence: |
| ||
| BDBM50534295 | |||
| n/a | |||
| Name | BDBM50534295 | ||
| Synonyms: | CHEMBL4521227 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C22H23FN4O | ||
| Mol. Mass. | 378.4426 | ||
| SMILES | Fc1ccc(COc2cccc(c2)-c2cn(nn2)[C@H]2CN3CCC2CC3)cc1 |r,wU:18.19,THB:15:18:21.22:25.24,(33.44,-52.15,;32.67,-50.81,;31.13,-50.8,;30.37,-49.46,;31.15,-48.14,;30.39,-46.8,;28.84,-46.79,;28.08,-45.45,;28.86,-44.12,;28.08,-42.78,;26.55,-42.78,;25.78,-44.11,;26.54,-45.44,;24.24,-44.1,;23.19,-45.23,;21.79,-44.58,;21.98,-43.05,;23.49,-42.76,;20.45,-45.33,;20.25,-46.72,;18.71,-46.06,;17.34,-46.69,;17.63,-45.3,;18.97,-44.69,;18.91,-43.05,;18.45,-44.16,;32.68,-48.14,;33.45,-49.47,)| | ||
| Structure | 
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