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Target
Sodium-dependent serotonin transporter
Ligand
BDBM50152948
Substrate
n/a
Meas. Tech.
ChEMBL_306337 (CHEMBL828157)
IC50
54±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:
BDBM50152948
Synonyms:
4-[4-(2-iodobenzyl)hexahydro-1-pyrazinyl]spiro[cyclohexane-1,7''-(2'',3'',7'',9''-tetrahydro[1,4]dioxino[3,2-e]isobenzofuran)]-9''-one | CHEMBL362363
Type:
Small organic molecule
Emp. Form.:
C26H29IN2O4
Mol. Mass.:
560.4239
SMILES:
Ic1ccccc1CN1CCN(CC1)[C@H]1CC[C@]2(CC1)OC(=O)c1c2ccc2OCCOc12 |wU:14.15,17.22,(7.84,-5.69,;7.87,-4.15,;9.29,-3.57,;9.49,-2.05,;8.26,-1.1,;6.84,-1.69,;6.64,-3.22,;5.22,-3.78,;3.99,-2.84,;2.57,-3.43,;1.36,-2.49,;1.57,-.96,;2.99,-.37,;4.2,-1.33,;.35,-.02,;-1.07,-.61,;-2.3,.33,;-2.09,1.86,;-.67,2.45,;.54,1.52,;-2.05,3.4,;-3.51,3.92,;-4.35,5.2,;-4.45,2.68,;-3.57,1.41,;-4.26,.02,;-5.8,-.08,;-6.66,1.19,;-8.2,1.07,;-9.05,2.35,;-8.39,3.75,;-6.83,3.85,;-5.98,2.56,)|
Structure:
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