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B0AT1 inhibitor compound 3

Chemical Structure : B0AT1 inhibitor compound 3

CAS No.: 2962069-39-0

B0AT1 inhibitor compound 3

Catalog No.: PC-27193Not For Human Use, Lab Use Only.

B0AT1 inhibitor compound 3 is a potent, selective, allosteric inhibitor of neutral amino acid transporter B0AT1 (SLC6A19) with IC50 of 513 nM and 295 nM for human and mouse B0AT1 respectively.

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    Biological Activity

    B0AT1 inhibitor compound 3 is a potent, selective, allosteric inhibitor of neutral amino acid transporter B0AT1 (SLC6A19) with IC50 of 513 nM and 295 nM for human and mouse B0AT1 respectively.
    B0AT1 inhibitor compound 3 shows high binding affinity with Kd of 47.0 nM in cell membrane-binding assays using human B0AT1-ACE2 co-expressing cells.
    B0AT1 inhibitor compound 3 preferentially binds to the Na⁺-bound conformation of B0AT1.
    B0AT1 inhibitor compound 3 treatment (30 mg/kg, oral) significantly increased urinary phenylalanine (Phe) excretion in phenylketonuria (PKU) model mice.

    Physicochemical Properties

    M.Wt 355.32
    Formula C16H16F3N3O3
    Appearance Solid
    CAS No.
    Storage
    Solide Powder
    -20°C 12 Months; 4°C 6 Months
    In Solvent
    -80°C 6 Months; -20°C 6 Months
    Shipping
    Solubility

    10 mM in DMSO

    Chemical Name/SMILES

    (E)-N-(2-oxo-2-(3-oxopiperazin-1-yl)ethyl)-3-(4-(trifluoromethyl)phenyl)acrylamide

    References

    1. Takuya Imazu, et al. Commun Biol. 2026 Jun 25. doi: 10.1038/s42003-026-10535-y.

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