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Assay Detail

CHEMBL1120513

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

Binding
Inhibition of tetrodotoxin-sensitive sodium channel
24
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Second generation N-(1,2-diphenylethyl)piperazines as dual serotonin and noradrenaline reuptake inhibitors: improving metabolic stability and reducing ion channel activity.
Fray MJ, Fish PV, Allan GA, Bish G, Clarke N, Eccles R, Harrison AC, Le Net JL, Phillips SC, Regan N, Sobry C, Stobie A, Wakenhut F, Westbrook D, Westbrook SL, Whitlock GA.
Bioorg Med Chem Lett (2010) 20 : 3788 -3792
PubMed 20471260 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 5.43 6.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL403441 1 6.10
CHEMBL1084033 1-(1-(4-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) 3 5.85
CHEMBL1083426 1-(1-(2-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) 2 5.85
CHEMBL1086275 1 5.74
CHEMBL375131 1 5.68
CHEMBL1083708 1-(2-(2-(DIFLUOROMETHOXY)PHENYL)-1-PHENYLETHYL)PIPERAZINE (ENANTIOMERIC MIX) 3 5.53
CHEMBL1084309 1 5.47
CHEMBL1083425 1 5.44
CHEMBL1086273 1 5.42
CHEMBL1085959 1 5.42
CHEMBL1083427 1 5.40
CHEMBL214335 3 5.35
CHEMBL1085321 1 5.34
CHEMBL1085567 1 5.32
CHEMBL1080787 1 5.07
CHEMBL1084971 1 4.94
CHEMBL1084577 1 4.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL403441 IC50 = 790.0 nM 6.10
CHEMBL1084033 1-(1-(4-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 1420.0 nM 5.85
CHEMBL1083426 1-(1-(2-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 1410.0 nM 5.85
CHEMBL1086275 IC50 = 1830.0 nM 5.74
CHEMBL375131 IC50 = 2100.0 nM 5.68
CHEMBL1084033 1-(1-(4-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 2960.0 nM 5.53
CHEMBL1083708 1-(2-(2-(DIFLUOROMETHOXY)PHENYL)-1-PHENYLETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 2970.0 nM 5.53
CHEMBL1084033 1-(1-(4-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 3140.0 nM 5.50
CHEMBL1083426 1-(1-(2-FLUOROPHENYL)-2-(2-(TRIFLUOROMETHOXY)PHENYL)ETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 3270.0 nM 5.49
CHEMBL1084309 IC50 = 3370.0 nM 5.47
CHEMBL1083425 IC50 = 3660.0 nM 5.44
CHEMBL1085959 IC50 = 3840.0 nM 5.42
CHEMBL1086273 IC50 = 3810.0 nM 5.42
CHEMBL1083427 IC50 = 3990.0 nM 5.40
CHEMBL214335 IC50 = 4470.0 nM 5.35
CHEMBL1085321 IC50 = 4540.0 nM 5.34
CHEMBL1083708 1-(2-(2-(DIFLUOROMETHOXY)PHENYL)-1-PHENYLETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 4700.0 nM 5.33
CHEMBL1085567 IC50 = 4830.0 nM 5.32
CHEMBL1083708 1-(2-(2-(DIFLUOROMETHOXY)PHENYL)-1-PHENYLETHYL)PIPERAZINE (ENANTIOMERIC MIX) IC50 = 4890.0 nM 5.31
CHEMBL214335 IC50 = 5400.0 nM 5.27
CHEMBL1080787 IC50 = 8550.0 nM 5.07
CHEMBL214335 IC50 = 8740.0 nM 5.06
CHEMBL1084971 IC50 = 11500.0 nM 4.94
CHEMBL1084577 IC50 = 15200.0 nM 4.82