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Target
Sodium-dependent serotonin transporter
Ligand
BDBM50304065
Substrate
n/a
Meas. Tech.
ChEMBL_601510 (CHEMBL1044205)
Ki
810±n/a nM
Citation
 Nielsen, S; Pedersen, CM; Hansen, SG; Petersen, MD; Sinning, S; Wiborg, O; Jensen, HH; Bols, M An extended study of dimeric phenyl tropanes. Bioorg Med Chem 17:4900-9 (2009) [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:
BDBM50304065
Synonyms:
CHEMBL594388 | trans-1,4-Di[3beta-(4-thiophene-3-yl-phenyl)tropane-2bcarbonyl-amino]cyclohexane
Type:
Small organic molecule
Emp. Form.:
C44H52N4O2S2
Mol. Mass.:
733.039
SMILES:
CN1C2CCC1[C@@H]([C@H](C2)c1ccc(cc1)-c1ccsc1)C(=O)N[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1C2CCC(C[C@@H]1c1ccc(cc1)-c1ccsc1)N2C |r,wU:7.10,32.36,38.44,26.33,6.23,wD:23.26,TLB:39:38:50:34.35,20:6:1:3.4,THB:30:32:50:34.35,9:7:1:3.4,(38.53,5.43,;37.77,4.09,;36.72,3.24,;37.35,1.91,;38.54,1.21,;37.53,2.54,;35.69,2.51,;34.73,1.68,;34.97,3.22,;33.95,.35,;34.72,-.99,;33.94,-2.31,;32.4,-2.3,;31.64,-.96,;32.42,.37,;31.51,-3.55,;29.97,-3.57,;29.5,-5.03,;30.76,-5.93,;31.99,-5.01,;35.08,4.43,;35.87,5.76,;33.54,4.45,;32.2,3.69,;30.86,4.46,;29.51,3.69,;29.52,2.14,;30.86,1.37,;32.2,2.14,;28.18,1.37,;26.85,2.14,;26.85,3.68,;25.52,1.36,;23.8,1.68,;22.93,.49,;21.64,.01,;22.88,1.14,;24.68,.79,;25.48,-.2,;26.19,-1.57,;25.34,-2.86,;26.05,-4.23,;27.59,-4.3,;28.42,-3,;27.71,-1.63,;28.3,-5.66,;27.41,-6.92,;28.33,-8.16,;29.79,-7.66,;29.77,-6.12,;22.91,2.71,;22.4,4.16,)|
Structure:
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