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Assay Detail

CHEMBL4031734

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

Binding
Inhibition of human BGT1 Y453S/Y454A double mutant expressed in tsA201 cells assessed as reduction in [3H]GABA uptake after 3 mins by scintillation counting method
6
Total Activities
3
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Sodium- and chloride-dependent betaine transporter (CHEMBL3715)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Activity Relationship, Pharmacological Characterization, and Molecular Modeling of Noncompetitive Inhibitors of the Betaine/γ-Aminobutyric Acid Transporter 1 (BGT1).
Jørgensen L, Al-Khawaja A, Kickinger S, Vogensen SB, Skovgaard-Petersen J, Rosenthal E, Borkar N, Löffler R, Madsen KK, Bräuner-Osborne H, Schousboe A, Ecker GF, Wellendorph P, Clausen RP.
J Med Chem (2017) 60 : 8834 -8846
PubMed 28991462 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 6 5.20 5.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL96 GAMMA-AMINOBUTYRIC ACID 1.0 2 5.52
CHEMBL1882801 2 5.26
CHEMBL4060376 2 4.89

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL96 GAMMA-AMINOBUTYRIC ACID IC50 = 3000.0 nM 5.52
CHEMBL96 GAMMA-AMINOBUTYRIC ACID IC50 = 3311.31 nM 5.48
CHEMBL1882801 IC50 = 5495.41 nM 5.26
CHEMBL1882801 IC50 = 6000.0 nM 5.22
CHEMBL4060376 IC50 = 12882.5 nM 4.89
CHEMBL4060376 IC50 = 15000.0 nM 4.82