Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C23H22FN3O4S.ClH |
| Molecular Weight | 491.963 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC1=C(C=CC(=C1F)S(C)(=O)=O)C(=O)N2CCOC3=C(C2)C=C(C=C3)C4=CC=C(N)N=C4
InChI
InChIKey=XUGXNTJUYGTLLW-UHFFFAOYSA-N
InChI=1S/C23H22FN3O4S.ClH/c1-14-18(5-7-20(22(14)24)32(2,29)30)23(28)27-9-10-31-19-6-3-15(11-17(19)13-27)16-4-8-21(25)26-12-16;/h3-8,11-12H,9-10,13H2,1-2H3,(H2,25,26);1H
DescriptionCurator's Comment: Description was created based on several sources, including
http://mct.aacrjournals.org/content/8/12_Supplement/B146 | https://www.ncbi.nlm.nih.gov/pubmed/23394126
Curator's Comment: Description was created based on several sources, including
http://mct.aacrjournals.org/content/8/12_Supplement/B146 | https://www.ncbi.nlm.nih.gov/pubmed/23394126
XL388 is a selective small-molecule ATP-competitive inhibitor of mTOR kinase complexes mTORC1 and mTORC2. XL388 inhibited cellular phosphorylation of mTOR complex 1 (p-p70S6K, pS6, and p-4E-BP1) and mTOR complex 2 (pAKT (S473)) substrates. In vitro, XL388 inhibits the viability of solid and hematopoietic tumor cell lines when assayed as a single agent. XL388 also synergizes with chemotherapeutics in cell‐based assays to block cell viability. When dosed orally once daily in mice, XL388 shows robust anti‐tumor activity in multiple xenograft models. Exelixis has discontinued the development of XL388. The company intends to pursue a collaboration partner or other external opportunities for the development of XL388.
Originator
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Discovery of a novel class of highly potent, selective, ATP-competitive, and orally bioavailable inhibitors of the mammalian target of rapamycin (mTOR). | 2013 Mar 28 |
|
| MicroRNA-21 Regulates the Proliferation, Differentiation, and Apoptosis of Human Renal Cell Carcinoma Cells by the mTOR-STAT3 Signaling Pathway. | 2016 |
Patents
Sample Use Guides
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1777807-51-8
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I36BZ5F3D1
Created by
admin on Sat Dec 16 09:17:40 GMT 2023 , Edited by admin on Sat Dec 16 09:17:40 GMT 2023
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131634503
Created by
admin on Sat Dec 16 09:17:40 GMT 2023 , Edited by admin on Sat Dec 16 09:17:40 GMT 2023
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ACTIVE MOIETY
SUBSTANCE RECORD
