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Target
Sodium-dependent serotonin transporter
Ligand
BDBM160620
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
pH
7.5±n/a
Temperature
277.15±n/a K
IC50
1.2±n/a nM
Comments
extracted
Citation
 Guzzo, PR; Liu, S; Ryan, KN; Molino, BF; DeOrazio, R; Olson, RE; Macor, JE 2,5-methano- and 2,5-ethano-tetrahydrobenzazepine derivatives and use thereof to block reuptake of norepinephrine, dopamine, and serotonin US Patent  US9045468 Publication Date 6/2/2015
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:
BDBM160620
Synonyms:
US9045468, 36
Type:
Small organic molecule
Emp. Form.:
C26H27ClN2O
Mol. Mass.:
418.958
SMILES:
Clc1ccc(cc1)C12CCN(CC1)Cc1cc(OCCCc3cccnc3)ccc21 |(3.92,5.77,;4.32,4.28,;5.81,3.88,;6.21,2.39,;5.12,1.3,;3.63,1.7,;3.23,3.19,;5.52,-.18,;7.02,-.53,;7.69,-1.92,;7.02,-3.3,;6.66,-1.67,;5.12,-1.67,;5.52,-3.65,;4.31,-2.69,;2.98,-3.46,;1.65,-2.69,;.31,-3.46,;-1.02,-2.69,;-2.35,-3.46,;-3.69,-2.69,;-5.02,-3.46,;-6.35,-2.69,;-7.69,-3.46,;-7.69,-5,;-6.35,-5.77,;-5.02,-5,;1.65,-1.15,;2.98,-.38,;4.31,-1.15,)|
Structure:
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