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25CN-NBOH | Agonist of HTR2A, HTR2C, HTR2B
RATINGS:
Cellular Use: (3 reviews)

In Model Organisms: (3 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
HTR2A
  • Ki:0.81 nM
  • EC 50:2.4 nM
HTR2C
  • Ki:42 nM (2C)
  • EC 50:350 nM
HTR2B
  • Ki:30 nM
    Agonist
    up to 500 nM

    Selectivity

    In Vitro Selectivity Assessment
    Potency Assay Off-Target:
    Broad profiling screens performed at Eurofins and PDSP
    Selectivity Assessment Description:
    25CN-NBOH also displayed appreciable binding affinity at 5-HT6 (Ki value of 310 nM), dopamine D4 (Ki ...
    In Vitro Selectivity Assessment
    Selectivity Assessment Description:
    Tested at a wide range of kinases and other enzymes in enzymatic assays, displaying no significant a ...

    Potency
    Cellular
    In Vitro

    HTR2A

    Mode of Action: Agonist

    Structure-Activity-Relationship data available? Yes

    DOI Reference: 10.1021/cn400216u

    HTR2C

    Mode of Action: Agonist

    Structure-Activity-Relationship data available? Yes

    DOI Reference: 10.1021/cn400216u

    HTR2B

    Mode of Action: Agonist

    Structure-Activity-Relationship data available? Yes

    DOI Reference: 10.1021/cn400216u

    In Vivo Validations

    Mouse
    Dose: 0.1 to 10 mg/Kg
    Route of delivery: Intraperitoneal, Subcutaneous
    Organ of interest (O): Brain

    DOI Reference: 10.1021/cn400216u

    Chemical Information

    Molecular Formula C18H20N2O3
    SMILEs COc1cc(CCNCc2ccccc2O)c(OC)cc1C#N
    InChI InChI=1S/C18H20N2O3/c1-22-17-10-15(11-19)18(23-2)9-13(17)7-8-20-12-14-5-3-4-6-16(14)21/h3-6,9-10,20-21H,7-8,12H2,1-2H3
    Molecular weight 312.15 Da
    AlogP 2.613380000000001
    HBond acceptors 5
    HBond donors 2
    Atoms 43
    PAINS * Yes

    * This is an automated alert only, and may not necessarily indicate an issue with this probe. ( Learn more about PAINS )

    References

    Publications

    Cross References

    canSARChEMBLBindingDBPDBPubMed

    Vendors

    Note: This is not an exhaustive list and does not indicate endorsement by the portal.

    Expert Reviews

    by SERP
    (on 25 Jul 2020 )
    Cellular Use Rating
    In Model Organisms
    Need to be aware compound is active on multiple targets - HTR2A, HTR2B, and HTR2C - when drawing biological conclusions from studies carried out with this compound. Important to measure drug concentrations...
    by SERP
    (on 4 Aug 2020 )
    Cellular Use Rating
    In Model Organisms
    ( The reviewer did not leave any comments )
    by SERP
    (on 13 Aug 2020 )
    Cellular Use Rating
    In Model Organisms
    Mode of in vivo delivery i.p or s.c. @ 1.5 mg/kg is indicated by Buchborn 2018. Note potential for rapid desensitization in mouse models
    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