Reaction Details | |||
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Target | 5-hydroxytryptamine receptor 1A | ||
Ligand | BDBM50252181 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_487560 (CHEMBL1013154) | ||
Ki | 6.2±n/a nM | ||
Citation | Zhou, D; Zhou, P; Evrard, DA; Meagher, K; Webb, M; Harrison, BL; Huryn, DM; Golembieski, J; Hornby, GA; Schechter, LE; Smith, DL; Andree, TH; Mewshaw, RE Studies toward the discovery of the next generation of antidepressants. Part 6: Dual 5-HT1A receptor and serotonin transporter affinity within a class of arylpiperazinyl-cyclohexyl indole derivatives. Bioorg Med Chem16:6707-23 (2008) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
5-hydroxytryptamine receptor 1A | |||
Name: | 5-hydroxytryptamine receptor 1A | ||
Synonyms: | 5-HT-1A | 5-HT1A | 5-hydroxytryptamine receptor 1A (5-HT-1A) | 5HT1A_HUMAN | ADRB2RL1 | ADRBRL1 | Dopamine D2 receptor and serotonin 1a receptor | G-21 | HTR1A | Serotonin receptor 1A | ||
Type: | n/a | ||
Mol. Mass.: | 46122.49 | ||
Organism: | Homo sapiens (Human) | ||
Description: | n/a | ||
Residue: | 422 | ||
Sequence: |
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BDBM50252181 | |||
n/a | |||
Name | BDBM50252181 | ||
Synonyms: | 3-[(1,4-trans)-4-(4-Quinolin-5-yl-piperazin-1-yl)-cyclohexyl]-1H-indole-5-carbonitrile | CHEMBL520753 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H29N5 | ||
Mol. Mass. | 435.5634 | ||
SMILES | N#Cc1ccc2[nH]cc([C@H]3CC[C@@H](CC3)N3CCN(CC3)c3cccc4ncccc34)c2c1 |r,wU:9.8,wD:12.15,(17.07,-23.33,;17.49,-24.83,;17.79,-26.34,;19.26,-26.83,;19.56,-28.34,;18.4,-29.36,;18.39,-30.89,;16.92,-31.35,;16.03,-30.1,;14.49,-30.09,;13.7,-31.41,;12.17,-31.4,;11.41,-30.06,;12.18,-28.73,;13.73,-28.75,;9.87,-30.05,;9.09,-31.38,;7.55,-31.36,;6.79,-30.03,;7.57,-28.7,;9.11,-28.7,;5.25,-30.02,;4.49,-31.35,;2.95,-31.35,;2.18,-30.01,;2.96,-28.68,;2.2,-27.35,;2.97,-26.03,;4.51,-26.03,;5.27,-27.37,;4.49,-28.69,;16.95,-28.86,;16.64,-27.36,)| | ||
Structure |