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Assay Detail

CHEMBL749359

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

Binding
Displacement of [3H]nisoxetine from norepinephrine transporter (NET) of rat brain
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Tissue Brain
Confidence 9 — Direct single protein target
Curated By Expert

Target

Norepinephrine transporter (CHEMBL304)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Structure-activity relationships at monoamine transporters for a series of N-substituted 3alpha-(bis[4-fluorophenyl]methoxy)tropanes: comparative molecular field analysis, synthesis, and pharmacological evaluation.
Kulkarni SS, Grundt P, Kopajtic T, Katz JL, Newman AH.
J Med Chem (2004) 47 : 3388 -3398
PubMed 15189035 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 14 5.63 6.21

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL317757 DIFLUOROBENZTROPINE 1 6.21
CHEMBL115253 1 6.20
CHEMBL112528 1 6.19
CHEMBL324518 1 5.95
CHEMBL3085021 1 5.85
CHEMBL3085020 1 5.85
CHEMBL2308105 1 5.66
CHEMBL3084884 1 5.53
CHEMBL325826 1 5.51
CHEMBL370805 COCAINE 4.0 1 5.48
CHEMBL327055 1 5.46
CHEMBL326706 1 5.44
CHEMBL111928 1 4.92
CHEMBL115710 1 4.55

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL317757 DIFLUOROBENZTROPINE Ki = 610.0 nM 6.21
CHEMBL115253 Ki = 637.0 nM 6.20
CHEMBL112528 Ki = 652.0 nM 6.19
CHEMBL324518 Ki = 1130.0 nM 5.95
CHEMBL3085021 Ki = 1420.0 nM 5.85
CHEMBL3085020 Ki = 1420.0 nM 5.85
CHEMBL2308105 Ki = 2210.0 nM 5.66
CHEMBL3084884 Ki = 2980.0 nM 5.53
CHEMBL325826 Ki = 3060.0 nM 5.51
CHEMBL370805 COCAINE Ki = 3300.0 nM 5.48
CHEMBL327055 Ki = 3450.0 nM 5.46
CHEMBL326706 Ki = 3650.0 nM 5.44
CHEMBL111928 Ki = 12100.0 nM 4.92
CHEMBL115710 Ki = 28100.0 nM 4.55