Chemical Probes logo
Taxol | Inhibitor of TUBB
RATINGS:
Cellular Use: (1 reviews)

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

Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
TUBB
    • EC50:9 nM
    Inhibitor
    5 uM

    Selectivity

    Potency
    Cellular
    In Vitro

    TUBB

    Mode of Action: Inhibitor

    Structure-Activity-Relationship data available? Yes

    PMID Reference: 10200249

    In Vivo Validations

    mouse, rabbit, rat
    Dose: 2-36 mg/kg
    Route of delivery: Intravenous
    Plasma half life: 0.65-3.7 h
    Systemic clearance: 0.15-2.94 L/h/kg
    Organ of interest (O): Broad tissue distribution, poor CNS penetrance
    Target engagement assay: HPLC assays

    DOI Reference: 10.1097/00001813-199801000-00001

    Chemical Information

    Molecular Formula C47H51NO14
    SMILEs CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C
    InChI InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1
    Molecular weight 853.33 Da
    AlogP 3.7357
    HBond acceptors 15
    HBond donors 4
    Atoms 113

    Vendors

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

    Expert Reviews

    by SERP
    (on 9 Sept 2017 )
    Cellular Use Rating
    In Model Organisms
    ( The reviewer did not leave any comments )

    Portal Comments

    ...

    (last updated: 7 Nov 2023)

    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