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Assay Detail

CHEMBL998745

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

Binding
Inhibition of norepinephrine uptake at human NET expressed in HEK293 cells
30
Total Activities
30
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sodium-dependent noradrenaline transporter (CHEMBL222)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-activity relationships of chiral selective norepinephrine reuptake inhibitors (sNRI) with increased oxidative stability.
Hudson S, Kiankarimi M, Eccles W, Dwight W, Mostofi YS, Genicot MJ, Fleck BA, Gogas K, Aparicio A, Wang H, Wen J, Wade WS.
Bioorg Med Chem Lett (2008) 18 : 4491 -4494
PubMed 18672364 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 30 7.29 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL444742 1 8.52
CHEMBL526270 1 8.52
CHEMBL180101 ESREBOXETINE 3.0 1 8.52
CHEMBL497512 1 8.40
CHEMBL497846 1 8.40
CHEMBL641 ATOMOXETINE 4.0 1 8.30
CHEMBL505433 1 8.30
CHEMBL525375 1 8.15
CHEMBL525238 1 8.15
CHEMBL524313 1 8.10
CHEMBL448375 1 8.10
CHEMBL497479 1 7.58
CHEMBL498120 1 7.57
CHEMBL526669 1 7.52
CHEMBL498509 1 7.46
CHEMBL498482 1 7.41
CHEMBL445082 1 7.40
CHEMBL497463 1 7.00
CHEMBL524798 1 7.00
CHEMBL498495 1 6.70
CHEMBL452429 1 6.64
CHEMBL498142 1 6.43
CHEMBL525717 1 6.43
CHEMBL497461 1 6.38
CHEMBL498481 1 6.16
CHEMBL498141 1 6.05
CHEMBL525532 1 6.00
CHEMBL443952 1 6.00
CHEMBL504606 1 5.89
CHEMBL510352 1 5.51

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL444742 IC50 = 3.0 nM 8.52
CHEMBL526270 IC50 = 3.0 nM 8.52
CHEMBL180101 ESREBOXETINE IC50 = 3.0 nM 8.52
CHEMBL497512 IC50 = 4.0 nM 8.40
CHEMBL497846 IC50 = 4.0 nM 8.40
CHEMBL641 ATOMOXETINE IC50 = 5.0 nM 8.30
CHEMBL505433 IC50 = 5.0 nM 8.30
CHEMBL525375 IC50 = 7.0 nM 8.15
CHEMBL525238 IC50 = 7.0 nM 8.15
CHEMBL524313 IC50 = 8.0 nM 8.10
CHEMBL448375 IC50 = 8.0 nM 8.10
CHEMBL497479 IC50 = 26.0 nM 7.58
CHEMBL498120 IC50 = 27.0 nM 7.57
CHEMBL526669 IC50 = 30.0 nM 7.52
CHEMBL498509 IC50 = 35.0 nM 7.46
CHEMBL498482 IC50 = 39.0 nM 7.41
CHEMBL445082 IC50 = 40.0 nM 7.40
CHEMBL497463 IC50 = 100.0 nM 7.00
CHEMBL524798 IC50 = 100.0 nM 7.00
CHEMBL498495 IC50 = 200.0 nM 6.70
CHEMBL452429 IC50 = 230.0 nM 6.64
CHEMBL498142 IC50 = 370.0 nM 6.43
CHEMBL525717 IC50 = 370.0 nM 6.43
CHEMBL497461 IC50 = 420.0 nM 6.38
CHEMBL498481 IC50 = 690.0 nM 6.16
CHEMBL498141 IC50 = 900.0 nM 6.05
CHEMBL525532 IC50 = 1000.0 nM 6.00
CHEMBL443952 IC50 = 1000.0 nM 6.00
CHEMBL504606 IC50 = 1300.0 nM 5.89
CHEMBL510352 IC50 = 3100.0 nM 5.51