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Robotnikinin 

Cat. No. M27826
Robotnikinin  Structure
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1mg USD 950  USD950 3-4 Weeks
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Biological Activity

Robotnikinin is a small molecule capable of binding to and inhibiting the activity of Sonic Hedgehog (Shh) signaling up stream of Smo.

Chemical Information
Molecular Weight 454.95
Formula C25H27ClN2O4
CAS Number 1132653-79-2
Storage Please store the product under the recommended conditions in the Certificate of Analysis.
Conversion of different model animals based on BSA (PMID: 27057123)
Species Mouse Rat Rabbit Guinea pig Hamster Dog
Weight (kg) 0.02 0.15 1.8 0.4 0.08 10
Body Surface Area (m2) 0.007 0.025 0.15 0.05 0.02 0.5
Km factor 3 6 12 8 5 20
Animal A (mg/kg) = Animal B (mg/kg) multiplied by  Animal B Km
Animal A Km

For example, to modify the dose of Compound A used for a mouse (20 mg/kg) to a dose based on the BSA for a rat, multiply 20 mg/kg by the Km factor for a mouse and then divide by the Km factor for a rat. This calculation results in a rat equivalent dose for Compound A of 10 mg/kg.

References

[1] Manuel Hitzenberger, et al. Front Chem. The Binding Mode of the Sonic Hedgehog Inhibitor Robotnikinin, a Combined Docking and QM/MM MD Study

[2] Chris Dockendorff, et al. ACS Med Chem Lett. Macrocyclic Hedgehog Pathway Inhibitors: Optimization of Cellular Activity and Mode of Action Studies

[3] Nadia B Hassounah, et al. Clin Cancer Res. Molecular pathways: the role of primary cilia in cancer progression and therapeutics with a focus on Hedgehog signaling

[4] Swan Hwang, et al. J Bioinform Comput Biol. Discovery and evaluation of potential sonic hedgehog signaling pathway inhibitors using pharmacophore modeling and molecular dynamics simulations

[5] Benjamin Z Stanton, et al. Mol Biosyst. Small-molecule modulators of the Sonic Hedgehog signaling pathway

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Keywords: Robotnikinin  supplier, Hedgehog, inhibitors, activators

 
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