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Target
Sodium-dependent serotonin transporter
Ligand
BDBM50152956
Substrate
n/a
Meas. Tech.
ChEMBL_306337 (CHEMBL828157)
IC50
110±n/a nM
Citation
 Boy, KM; Dee, M; Yevich, J; Torrente, J; Gao, Q; Iben, L; Stark, A; Mattson, RJ Ligand conformation has a definitive effect on 5-HT1A and serotonin reuptake affinity. Bioorg Med Chem Lett 14:4467-70 (2004) [PubMed]  Article 
Target
Name:
Sodium-dependent serotonin transporter
Synonyms:
5-HT Transporter | 5HT transporter | 5HTT | HTT | SC6A4_HUMAN | SERT | SLC6A4 | Serotonin Transporter (SERT) | Serotonin transporter (5HTT) | Serotonin transporter protein (SERT) | Sodium-dependent serotonin transporter (SERT) | Solute carrier family 6 member 4
Type:
Multi-pass membrane protein
Mol. Mass.:
70322.51
Organism:
Homo sapiens (Human)
Description:
P31645
Residue:
630
Sequence:
METTPLNSQKQLSACEDGEDCQENGVLQKVVPTPGDKVESGQISNGYSAVPSPGAGDDTRHSIPATTTTLVAELHQGERETWGKKVDFLLSVIGYAVDLGNVWRFPYICYQNGGGAFLLPYTIMAIFGGIPLFYMELALGQYHRNGCISIWRKICPIFKGIGYAICIIAFYIASYYNTIMAWALYYLISSFTDQLPWTSCKNSWNTGNCTNYFSEDNITWTLHSTSPAEEFYTRHVLQIHRSKGLQDLGGISWQLALCIMLIFTVIYFSIWKGVKTSGKVVWVTATFPYIILSVLLVRGATLPGAWRGVLFYLKPNWQKLLETGVWIDAAAQIFFSLGPGFGVLLAFASYNKFNNNCYQDALVTSVVNCMTSFVSGFVIFTVLGYMAEMRNEDVSEVAKDAGPSLLFITYAEAIANMPASTFFAIIFFLMLITLGLDSTFAGLEGVITAVLDEFPHVWAKRRERFVLAVVITCFFGSLVTLTFGGAYVVKLLEEYATGPAVLTVALIEAVAVSWFYGITQFCRDVKEMLGFSPGWFWRICWVAISPLFLLFIICSFLMSPPQLRLFQYNYPYWSIILGYCIGTSSFICIPTYIAYRLIITPGTFKERIIKSITPETPTEIPCGDIRLNAV
  
Inhibitor
Name:
BDBM50152956
Synonyms:
4-[4-(2,5-difluorobenzyl)hexahydro-1-pyridinyl]spiro[cyclohexane-1,7''-(2'',3'',7'',9''-tetrahydro[1,4]dioxino[3,2-e]isobenzofuran)]-9''-one | CHEMBL363328
Type:
Small organic molecule
Emp. Form.:
C27H29F2NO4
Mol. Mass.:
469.5203
SMILES:
Fc1ccc(F)c(CC2CCN(CC2)[C@H]2CC[C@]3(CC2)OC(=O)c2c3ccc3OCCOc23)c1 |wU:14.14,17.21,(8.24,.41,;8.03,-1.1,;9.25,-2.06,;9.04,-3.58,;7.62,-4.16,;7.41,-5.7,;6.4,-3.23,;4.98,-3.8,;3.77,-2.86,;2.34,-3.44,;1.13,-2.51,;1.33,-.96,;2.75,-.38,;3.98,-1.34,;.1,-.03,;-1.32,-.61,;-2.54,.32,;-2.33,1.84,;-.91,2.44,;.31,1.49,;-2.3,3.4,;-3.76,3.91,;-4.6,5.2,;-4.69,2.68,;-3.82,1.39,;-4.5,.02,;-6.04,-.1,;-6.91,1.18,;-8.44,1.07,;-9.31,2.35,;-8.63,3.73,;-7.09,3.84,;-6.23,2.56,;6.61,-1.71,)|
Structure:
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