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Assay Detail

CHEMBL1176113

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

Binding
Inhibition of [3H]dopamine reuptake at human DAT expressed in HEK293 cells after 90 mins by scintillation counting
26
Total Activities
26
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 dopamine transporter (CHEMBL238)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis and characterization of in vitro and in vivo profiles of hydroxybupropion analogues: aids to smoking cessation.
Lukas RJ, Muresan AZ, Damaj MI, Blough BE, Huang X, Navarro HA, Mascarella SW, Eaton JB, Marxer-Miller SK, Carroll FI.
J Med Chem (2010) 53 : 4731 -4748
PubMed 20509659 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 26 5.88 7.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1173597 1 7.52
CHEMBL1173428 1 7.16
CHEMBL1173772 1 6.69
CHEMBL1173354 1 6.54
CHEMBL1173771 1 6.34
CHEMBL1172929 1 6.20
CHEMBL894 BUPROPION 4.0 1 6.18
CHEMBL1170441 1 6.08
CHEMBL1173429 1 5.99
CHEMBL1173274 1 5.97
CHEMBL1173275 1 5.86
CHEMBL1173427 1 5.67
CHEMBL1173277 1 5.58
CHEMBL1173598 1 5.54
CHEMBL1173276 1 5.48
CHEMBL1171260 1 5.47
CHEMBL1173353 1 5.38
CHEMBL1173430 1 5.08
CHEMBL1173770 1 5.00
CHEMBL1173280 1 4.92
CHEMBL1173279 1 4.80
CHEMBL1173599 1 -
CHEMBL1173701 1 -
CHEMBL1173600 1 -
CHEMBL1173355 1 -
CHEMBL1172928 RADAFAXINE 2.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1173597 IC50 = 30.0 nM 7.52
CHEMBL1173428 IC50 = 70.0 nM 7.16
CHEMBL1173772 IC50 = 204.0 nM 6.69
CHEMBL1173354 IC50 = 285.0 nM 6.54
CHEMBL1173771 IC50 = 453.0 nM 6.34
CHEMBL1172929 IC50 = 630.0 nM 6.20
CHEMBL894 BUPROPION IC50 = 660.0 nM 6.18
CHEMBL1170441 IC50 = 832.0 nM 6.08
CHEMBL1173429 IC50 = 1020.0 nM 5.99
CHEMBL1173274 IC50 = 1065.0 nM 5.97
CHEMBL1173275 IC50 = 1380.0 nM 5.86
CHEMBL1173427 IC50 = 2140.0 nM 5.67
CHEMBL1173277 IC50 = 2600.0 nM 5.58
CHEMBL1173598 IC50 = 2870.0 nM 5.54
CHEMBL1173276 IC50 = 3340.0 nM 5.48
CHEMBL1171260 IC50 = 3400.0 nM 5.47
CHEMBL1173353 IC50 = 4200.0 nM 5.38
CHEMBL1173430 IC50 = 8250.0 nM 5.08
CHEMBL1173770 IC50 = 10000.0 nM 5.00
CHEMBL1173280 IC50 = 12000.0 nM 4.92
CHEMBL1173279 IC50 = 16000.0 nM 4.80
CHEMBL1173599 IC50 > 100000.0 nM -
CHEMBL1173701 IC50 > 100000.0 nM -
CHEMBL1173600 IC50 > 100000.0 nM -
CHEMBL1173355 IC50 > 100000.0 nM -
CHEMBL1172928 RADAFAXINE IC50 > 100000.0 nM -