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Assay Detail

CHEMBL4398053

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

Binding
Inhibition of human GAT2 expressed in Flp-In CHO cells assessed as reduction in [3H]GABA uptake incubated for 3 mins by liquid scintillation counting method
17
Total Activities
11
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 GABA transporter 2 (CHEMBL4535)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Five-Membered N-Heterocyclic Scaffolds as Novel Amino Bioisosteres at γ-Aminobutyric Acid (GABA) Type A Receptors and GABA Transporters.
Giraudo A, Krall J, Bavo F, Nielsen B, Kongstad KT, Rolando B, De Blasio R, Gloriam DE, Löffler R, Thiesen L, Harpsøe K, Frydenvang K, Boschi D, Wellendorph P, Lolli ML, Jensen AA, Frølund B.
J Med Chem (2019) 62 : 5797 -5809
PubMed 31117514 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 4.96 5.54

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4458674 2 5.54
CHEMBL1788265 2 5.14
CHEMBL79325 2 5.10
CHEMBL349005 2 4.80
CHEMBL96 GAMMA-AMINOBUTYRIC ACID 1.0 1 4.58
CHEMBL4526098 2 -
CHEMBL4471977 1 -
CHEMBL4586460 1 -
CHEMBL4455221 1 -
CHEMBL4442696 1 -
CHEMBL4464494 2 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4458674 IC50 = 2900.0 nM 5.54
CHEMBL4458674 IC50 = 3162.28 nM 5.50
CHEMBL1788265 IC50 = 7300.0 nM 5.14
CHEMBL79325 IC50 = 7943.28 nM 5.10
CHEMBL1788265 IC50 = 7943.28 nM 5.10
CHEMBL349005 IC50 = 16000.0 nM 4.80
CHEMBL349005 IC50 = 15848.93 nM 4.80
CHEMBL96 GAMMA-AMINOBUTYRIC ACID IC50 = 26000.0 nM 4.58
CHEMBL79325 IC50 = 79100.0 nM 4.10
CHEMBL4442696 IC50 > 100000.0 nM -
CHEMBL4464494 IC50 > 100000.0 nM -
CHEMBL4464494 IC50 > 100000.0 nM -
CHEMBL4455221 IC50 > 100000.0 nM -
CHEMBL4586460 IC50 > 100000.0 nM -
CHEMBL4471977 IC50 > 100000.0 nM -
CHEMBL4526098 IC50 = 125892.54 nM -
CHEMBL4526098 IC50 = 132200.0 nM -