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Target
Sodium-dependent serotonin transporter
Ligand
BDBM160609
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
pH
7.5±n/a
Temperature
277.15±n/a K
IC50
1.5±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:
BDBM160609
Synonyms:
US9045468, 23
Type:
Small organic molecule
Emp. Form.:
C24H21ClN4O
Mol. Mass.:
416.903
SMILES:
Clc1ccc(cc1)C12CCN(CC1)Cc1cc(ccc21)-n1nc2ccccn2c1=O |(2.3,6.2,;2.7,4.72,;4.18,4.32,;4.58,2.83,;3.49,1.74,;2.01,2.14,;1.61,3.63,;3.89,.25,;5.39,-.09,;6.06,-1.48,;5.39,-2.86,;5.03,-1.23,;3.49,-1.23,;3.89,-3.21,;2.69,-2.25,;1.35,-3.02,;.02,-2.25,;.02,-.71,;1.35,.06,;2.69,-.71,;-1.31,-3.02,;-2.72,-2.39,;-3.75,-3.54,;-5.29,-3.54,;-6.06,-4.87,;-5.29,-6.2,;-3.75,-6.2,;-2.98,-4.87,;-1.47,-4.55,;-.39,-5.64,)|
Structure:
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