Reaction Details | |||
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Target | 5-hydroxytryptamine receptor 3A/3B | ||
Ligand | BDBM50000467 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_3411 (CHEMBL620725) | ||
Ki | 2.5±n/a nM | ||
Citation | Clark, RD; Miller, AB; Berger, J; Repke, DB; Weinhardt, KK; Kowalczyk, BA; Eglen, RM; Bonhaus, DW; Lee, CH; Michel, AD 2-(Quinuclidin-3-yl)pyrido[4,3-b]indol-1-ones and isoquinolin-1-ones. Potent conformationally restricted 5-HT3 receptor antagonists. J Med Chem36:2645-57 (1993) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
5-hydroxytryptamine receptor 3A/3B | |||
Name: | 5-hydroxytryptamine receptor 3A/3B | ||
Synonyms: | Serotonin 3 (5-HT3) receptor | Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor | ||
Type: | n/a | ||
Mol. Mass.: | n/a | ||
Description: | ASSAY_ID of EBI is 2974 | ||
Components: | This complex has 2 components. | ||
Component 1 | |||
Name: | 5-hydroxytryptamine receptor 3B | ||
Synonyms: | 5HT3B_RAT | Htr3b | Serotonin (5-HT) receptor | ||
Type: | PROTEIN | ||
Mol. Mass.: | 50328.78 | ||
Organism: | Rattus norvegicus | ||
Description: | EBI_11885 | ||
Residue: | 437 | ||
Sequence: |
| ||
Component 2 | |||
Name: | 5-hydroxytryptamine receptor 3A | ||
Synonyms: | 5-HT3 | 5-hydroxytryptamine receptor 3A | 5HT3A_RAT | 5ht3 | Htr3 | Htr3a | Serotonin (5-HT) receptor | Zacopride site-R | ||
Type: | Enzyme Catalytic Domain | ||
Mol. Mass.: | 55428.70 | ||
Organism: | RAT | ||
Description: | 5-HT3 HTR3A RAT::P35563 | ||
Residue: | 483 | ||
Sequence: |
| ||
BDBM50000467 | |||
n/a | |||
Name | BDBM50000467 | ||
Synonyms: | CHEMBL544785 | ||
Type | Small organic molecule | ||
Emp. Form. | C20H26ClN3O | ||
Mol. Mass. | 359.893 | ||
SMILES | Cl.O=C(NC1CN2CCC1CC2)c1c2CCCCn2c2ccccc12 |(6.69,-3.57,;-1.11,-3.67,;0,-3.02,;1.4,-3.83,;1.4,-5.44,;-.07,-6.25,;-.08,-7.93,;1.5,-7.67,;1.53,-6.36,;2.88,-6.26,;2.86,-7.95,;1.38,-8.79,;,-1.41,;-1.32,-.65,;-2.67,-1.41,;-3.97,-.65,;-3.97,.88,;-2.67,1.65,;-1.32,.88,;1.32,.88,;2.65,1.65,;4.01,.88,;4.01,-.65,;2.65,-1.41,;1.32,-.65,)| | ||
Structure |