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Target
Sodium-dependent serotonin transporter
Ligand
BDBM50152947
Substrate
n/a
Meas. Tech.
ChEMBL_306337 (CHEMBL828157)
IC50
82±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:
BDBM50152947
Synonyms:
4-[4-(2-bromo-5-fluorobenzyl)hexahydro-1-pyridinyl]spiro[cyclohexane-1,6''-(6'',8''-dihydro[1,3]dioxolo[5,4-e]isobenzofuran)]-8''-one | CHEMBL360790
Type:
Small organic molecule
Emp. Form.:
C26H27BrFNO4
Mol. Mass.:
516.399
SMILES:
Fc1ccc(Br)c(CC2CCN(CC2)[C@H]2CC[C@]3(CC2)OC(=O)c2c4OCOc4ccc32)c1 |wU:14.14,17.21,(7.95,.5,;7.74,-1.01,;8.97,-1.97,;8.76,-3.48,;7.34,-4.06,;7.12,-5.6,;6.11,-3.13,;4.69,-3.71,;3.47,-2.76,;2.05,-3.34,;.85,-2.41,;1.05,-.87,;2.47,-.29,;3.69,-1.24,;-.16,.06,;-1.6,-.52,;-2.81,.41,;-2.6,1.95,;-1.19,2.53,;.03,1.6,;-2.58,3.49,;-4.02,4,;-4.86,5.28,;-4.96,2.77,;-6.49,2.65,;-7.59,3.72,;-8.94,3,;-8.68,1.48,;-7.17,1.27,;-6.31,-.01,;-4.77,.11,;-4.08,1.48,;6.32,-1.62,)|
Structure:
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