Reaction Details | |||
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Target | 5-hydroxytryptamine receptor 3A | ||
Ligand | BDBM50406132 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_2266221 | ||
IC50 | 1590±n/a nM | ||
Citation | Roecker, AJ; Schirripa, KM; Loughran, HM; Tong, L; Liang, T; Fillgrove, KL; Kuo, Y; Bleasby, K; Collier, H; Altman, MD; Ford, MC; Drolet, RE; Cosden, M; Jinn, S; Hatcher, NG; Yao, L; Kandebo, M; Vardigan, JD; Flick, RB; Liu, X; Minnick, C; Price, LA; Watt, ML; Lemaire, W; Burlein, C; Adam, GC; Austin, LA; Marcus, JN; Smith, SM; Fraley, ME Pyrazole Ureas as Low Dose, CNS Penetrant Glucosylceramide Synthase Inhibitors for the Treatment of Parkinson's Disease. ACS Med Chem Lett14:146-155 (2023) [PubMed] | ||
More Info.: | Get all data from this article, Assay Method | ||
5-hydroxytryptamine receptor 3A | |||
Name: | 5-hydroxytryptamine receptor 3A | ||
Synonyms: | 5-HT-3 | 5-HT3 | 5-HT3A | 5-HT3R | 5-hydroxytryptamine receptor 3 (5-HT3) | 5-hydroxytryptamine receptor 3A (5-HT3a) | 5-hydroxytryptamine receptor 3A (5HT3A) | 5HT3A_HUMAN | 5HT3R | HTR3 | HTR3A | Serotonin 3 (5-HT3) receptor | Serotonin 3 receptor (5HT3) | Serotonin receptor 3A | Serotonin-gated ion channel receptor | Serotonin-gated ion channel receptor 3 | ||
Type: | Protein | ||
Mol. Mass.: | 55283.27 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P46098 | ||
Residue: | 478 | ||
Sequence: |
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BDBM50406132 | |||
n/a | |||
Name | BDBM50406132 | ||
Synonyms: | CHEMBL5273314 | ||
Type | Small organic molecule | ||
Emp. Form. | C21H23F3N4O2 | ||
Mol. Mass. | 420.4281 | ||
SMILES | FC(F)(F)c1ccc(cc1)-c1nn(C(=O)N2CCN3CCC2CC3)c2COCCc12 |(2.68,-5.79,;1.19,-5.39,;.1,-6.48,;1.59,-6.88,;.8,-3.9,;1.82,-2.77,;1.31,-1.28,;-.18,-.98,;-1.21,-2.1,;-.74,-3.59,;-.64,.46,;.28,1.75,;-.64,2.98,;-.18,4.41,;-1.26,5.54,;1.31,4.77,;2.28,3.54,;3.82,3.54,;4.8,4.72,;3.46,4.36,;2.23,4.98,;1.72,6.26,;3.11,6.88,;4.49,6.21,;-2.13,2.52,;-3.46,3.29,;-4.8,2.52,;-4.8,.98,;-3.46,.21,;-2.13,.98,)| | ||
Structure |