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TAK-861 | TAK-861 : Agonist of HCRTR2
RATINGS:
Cellular Use: (0 reviews)

In Model Organisms: (1 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
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Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
HCRTR2
    • EC50:31.7 nM
    • EC50:1.2 nM
    • EC50:30 nM
    • EC50:34 nM
    • EC50:3.6 nM
    • EC50:2.5 nM
    Agonist
    up to1 uM

    Selectivity

    In Vitro Selectivity Assessment
    Potency Assay Off-Target:
    Selectivity within target family: 3000-fold selective over OX1R Selectivity outside target family: ...

    Potency
    Cellular
    In Vitro

    HCRTR2

    Mode of Action: Agonist

    Structure-Activity-Relationship data available? No

    DOI Reference: 10.1038/s41598-024-70594-1

    In Vivo Validations

    Mouse
    Dose: 0.03, 0.1, 0.3 and 1 mg/kg
    Route of delivery: Oral

    DOI Reference: 10.1038/s41598-024-70594-1

    Chemical Information

    Molecular Formula C23H25F5N2O4S
    SMILEs CCS(=O)(=O)N[C@@H]1[C@H](Cc2cccc(-c3cc(F)cc(F)c3)c2F)N(C(=O)C(C)(C)O)CC1(F)F
    InChI InChI=1S/C23H25F5N2O4S/c1-4-35(33,34)29-20-18(30(12-23(20,27)28)21(31)22(2,3)32)10-13-6-5-7-17(19(13)26)14-8-15(24)11-16(25)9-14/h5-9,11,18,20,29,32H,4,10,12H2,1-3H3/t18-,20+/m0/s1
    Molecular weight 520.15 Da
    AlogP 3.2383000000000015
    HBond acceptors 6
    HBond donors 2
    Atoms 60

    References

    Publications

    Cross References

    Expert Reviews

    by SERP
    (on 5 Feb 2025 )
    In Model Organisms
    This probe targets an extracellular protein and therefore does not require an intracellular evaluation. TAK-861 has also been tested on male cynomolgus monkey (1 mg/kg, p.o.)
    Note: The Chemical Probes Portal only endorses compounds as chemical probes for use as specific and selective modulators of the proposed target if they receive three or more (3-4) stars. Read more about our evaluation criteria