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Target
5-hydroxytryptamine receptor 3A
Ligand
BDBM99942
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
pH
7.5±0
Ki
25±0.0 nM
Citation
 Manning, DD; Cioffi, CL 5-HT3 receptor modulators, methods of making, and use thereof US Patent  US8501729 Publication Date 8/6/2013 
Target
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:
MLLWVQQALLALLLPTLLAQGEARRSRNTTRPALLRLSDYLLTNYRKGVRPVRDWRKPTTVSIDVIVYAILNVDEKNQVLTTYIWYRQYWTDEFLQWNPEDFDNITKLSIPTDSIWVPDILINEFVDVGKSPNIPYVYIRHQGEVQNYKPLQVVTACSLDIYNFPFDVQNCSLTFTSWLHTIQDINISLWRLPEKVKSDRSVFMNQGEWELLGVLPYFREFSMESSNYYAEMKFYVVIRRRPLFYVVSLLLPSIFLMVMDIVGFYLPPNSGERVSFKITLLLGYSVFLIIVSDTLPATAIGTPLIGVYFVVCMALLVISLAETIFIVRLVHKQDLQQPVPAWLRHLVLERIAWLLCLREQSTSQRPPATSQATKTDDCSAMGNHCSHMGGPQDFEKSPRDRCSPPPPPREASLAVCGLLQELSSIRQFLEKRDEIREVARDWLRVGSVLDKLLFHIYLLAVLAYSITLVMLWSIWQYA
  
Inhibitor
Name:
BDBM99942
Synonyms:
US8501729, 30
Type:
Small organic molecule
Emp. Form.:
C24H25N3O3S
Mol. Mass.:
435.539
SMILES:
O=C1N(CCc2cn(c3cccc1c23)S(=O)(=O)c1ccccc1)[C@@H]1CN2CCC1CC2 |r,wD:23.26,(-.74,2.42,;.74,2.03,;1.79,3.15,;3.33,3.04,;4.19,1.77,;3.77,.21,;4.68,-1.04,;3.77,-2.28,;2.31,-1.81,;.97,-2.58,;-.36,-1.81,;-.36,-.27,;.97,.5,;2.31,-.27,;4.25,-3.75,;2.78,-4.22,;5.71,-3.27,;4.72,-5.21,;6.23,-5.53,;6.7,-7,;5.67,-8.14,;4.17,-7.82,;3.69,-6.36,;1.39,4.64,;-.1,5.04,;-.49,6.53,;.59,7.62,;2.08,7.22,;2.48,5.73,;.99,5.39,;.99,6.93,)|
Structure:
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