Reaction Details | |||
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Target | Neuronal acetylcholine receptor subunit alpha-4/beta-2 | ||
Ligand | BDBM50006613 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1335280 (CHEMBL3238704) | ||
Ki | 562±n/a nM | ||
Citation | Gao, Y; Kellar, KJ; Yasuda, RP; Tran, T; Xiao, Y; Dannals, RF; Horti, AG Derivatives of dibenzothiophene for positron emission tomography imaging ofa7-nicotinic acetylcholine receptors. J Med Chem56:7574-89 (2013) [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: |
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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: |
| ||
BDBM50006613 | |||
n/a | |||
Name | BDBM50006613 | ||
Synonyms: | CHEMBL3235480 | ||
Type | Small organic molecule | ||
Emp. Form. | C19H19FN2O2S | ||
Mol. Mass. | 358.43 | ||
SMILES | Fc1cccc2-c3ccc(cc3S(=O)(=O)c12)N1CCN2CCC1CC2 |(1.16,-6.38,;2.07,-7.63,;1.43,-9.05,;2.34,-10.28,;3.87,-10.12,;4.51,-8.71,;5.96,-8.23,;7.3,-9.01,;8.63,-8.24,;8.64,-6.69,;7.3,-5.92,;5.97,-6.69,;4.51,-6.22,;4.82,-4.71,;3.36,-5.19,;3.6,-7.47,;9.98,-5.92,;11.17,-6.88,;12.67,-6.54,;13.34,-5.16,;12.67,-3.76,;11.18,-3.42,;9.98,-4.37,;11.27,-4.4,;11.9,-5.97,)| | ||
Structure |