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Assay Detail

CHEMBL2389179

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Displacement of [3H]-citalopram from Sprague-Dawley rat brain SERT after 1 hr
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sodium-dependent serotonin transporter (CHEMBL313)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Discovery of a potent, dual serotonin and norepinephrine reuptake inhibitor.
Dreyfus N, Myers JK, Badescu VO, de Frutos O, de la Puente ML, Ding C, Filla SA, Fynboe K, Gernert DL, Heinz BA, Hemrick-Luecke SK, Johnson KW, Johnson MP, López P, Love PL, Martin LJ, Masquelin T, McCoy MJ, Mendiola J, Morrow D, Muhlhauser M, Pascual G, Perun TJ, Pfeifer LA, Phebus LA, Richards SJ, Rincón JA, Seest EP, Shah J, Shaojuan J, Simmons RM, Stephenson GA, Tromiczak EG, Thompson LK, Walter MW, Weber WW, Zarrinmayeh H, Thomas CE, Joshi E, Iyengar S, Johansson AM.
ACS Med Chem Lett (2013) 4 : 560 -564
PubMed 24900709 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 5 8.77 10.09

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1175 DULOXETINE 4.0 1 10.09
CHEMBL2386162 1 9.80
CHEMBL637 VENLAFAXINE 4.0 1 7.60
CHEMBL259209 MILNACIPRAN 4.0 1 7.57
CHEMBL1118 DESVENLAFAXINE 4.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1175 DULOXETINE Ki = 0.082 nM 10.09
CHEMBL2386162 Ki = 0.16 nM 9.80
CHEMBL637 VENLAFAXINE Ki = 25.0 nM 7.60
CHEMBL259209 MILNACIPRAN Ki = 27.0 nM 7.57
CHEMBL1118 DESVENLAFAXINE Ki > 324.0 nM -