103 Publications (Page 1 of 5)
2023
Chloroacetamide fragment library screening identifies new scaffolds for covalent inhibition of the TEAD·YAP1 interaction. RSC Medicinal Chemistry
. | Journal Article
 
Covalent Fragment Inhibits RhoA Activation by Guanine Exchange Factors. ACS Chemical Neuroscience
. | Journal Article
 
Crystal Packing Reveals a Potential Autoinhibited KRAS Dimer Interface and a Strategy for Small-Molecule Inhibition of RAS Signaling. Biochemistry
. | Journal Article
 
Exploring Covalent Bond Formation at Tyr‐82 for Inhibition of Ral GTPase Activation. ChemMedChem
. | Journal Article
2022
Covalent Fragment Screening Identifies Rgl2 RalGEF Cysteine for Targeted Covalent Inhibition of Ral GTPase Activation
Bum-Erdene, Khuchtumur⋅Ghozayel, Mona K.⋅Xu, David and Meroueh, Samy
ChemMedChem. | Journal Article
 
Small-Molecule Cyanamide Pan-TEAD·YAP1 Covalent Antagonists. Journal of Medicinal Chemistry
. | Journal Article
2021
Atractylenolide I enhances responsiveness to immune checkpoint blockade therapy by activating tumor antigen presentation
Xu, Hanchen⋅Xu, Hanchen⋅Xu, Hanchen⋅Xu, Hanchen⋅Xu, H.⋅Van der Jeught, Kevin⋅Van Der Jeught, K.⋅Van der Jeught, Kevin⋅Van der Jeught, Kevin⋅Van der Jeught, Kevin⋅Zhou, Zhuolong⋅Zhou, Zhuolong⋅Zhou, Zhuolong⋅Zhou, Z.⋅Zhou, Zhuolong⋅Zhang, Lu⋅Zhang, L.⋅Zhang, Lu⋅Zhang, Lu⋅Zhang, Lu⋅Yu, T.⋅Yu, Tao⋅Yu, Tao⋅Yu, Tao⋅Yu, Tao⋅Sun, Yifan⋅Sun, Yifan⋅Sun, Yifan⋅Sun, Y.⋅Sun, Yifan⋅Li, Yujing⋅Li, Yujing⋅Li, Y.⋅Li, Yujing⋅Li, Yujing⋅Wan, Changlin⋅Wan, Changlin⋅Wan, C.⋅Wan, Changlin⋅Wan, Changlin⋅So, K.M.⋅So, Ka M⋅So, Kaman⋅So, Kaman⋅So, Ka M⋅Liu, Degang⋅Liu, D.⋅Liu, Degang⋅Liu, Degang⋅Liu, Degang⋅Frieden, M.⋅Frieden, Michael⋅Frieden, Michael⋅Frieden, Michael⋅Frieden, Michael⋅Fang, Yuanzhang⋅Fang, Yuanzhang⋅Fang, Yuanzhang⋅Fang, Yuanzhang⋅Fang, Y.⋅Mosley, Amber L⋅Mosley, A.L.⋅Mosley, Amber L⋅Mosley, Amber L⋅Mosley, Amber L⋅He, Xiaoming⋅He, X.⋅He, Xiaoming⋅He, Xiaoming⋅He, Xiaoming⋅Zhang, Xinna⋅Zhang, Xinna⋅Zhang, Xinna⋅Zhang, X.⋅Zhang, Xinna⋅Sandusky, George E⋅Sandusky, G.E.⋅Sandusky, George E⋅Sandusky, George E⋅Sandusky, George E⋅Liu, Y.⋅Liu, Yunlong⋅Liu, Yunlong⋅Liu, Yunlong⋅Liu, Yunlong⋅Meroueh, S.O.⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Zhang, C.⋅Zhang, Chi⋅Zhang, Chi⋅Zhang, Chi⋅Zhang, Chi⋅Wijeratne, Aruna B⋅Wijeratne, Aruna B⋅Wijeratne, Aruna B⋅Wijeratne, A.B.⋅Wijeratne, Aruna B⋅Huang, C.⋅Huang, Cheng⋅Huang, Cheng⋅Huang, Cheng⋅Huang, Cheng⋅Ji, Guang⋅Ji, G.⋅Ji, Guang⋅Ji, Guang⋅Ji, Guang⋅Lu, Xiongbin⋅Lu, Xiongbin⋅Lu, X.⋅Lu, Xiongbin and Lu, Xiongbin
Journal of Clinical Investigation, vol. 131, (no. 10), pp. 1-15, May 2021. | Journal Article
2020
Design and Synthesis of Fragment Derivatives with a Unique Inhibition Mechanism of the uPAR·uPA Interaction
ACS Medicinal Chemistry Letters. | Journal Article
 
Phenotypic Screening of Chemical Libraries Enriched by Molecular Docking to Multiple Targets Selected from Glioblastoma Genomic Data
Xu, David⋅Xu, David⋅Xu, David⋅Xu, David⋅Xu, David⋅Xu, David⋅Xu, David⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Sishtla, Kamakshi⋅Liu, Sheng⋅Liu, Sheng⋅Liu, Sheng⋅Liu, Sheng⋅Liu, Sheng⋅Liu, Sheng⋅Liu, Sheng⋅Wan, Jun⋅Wan, Jun⋅Wan, Jun⋅Wan, Jun⋅Wan, Jun⋅Wan, Jun⋅Wan, Jun⋅Aryal, Uma K⋅Aryal, Uma K⋅Aryal, Uma K⋅Aryal, Uma K⋅Aryal, Uma K⋅Aryal, Uma K⋅Aryal, Uma K⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Lee, Jonathan A⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Fishel, Melissa L⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Pollok, Karen⋅Pollok, Karen⋅Pollok, Karen⋅Pollok, Karen E⋅Pollok, Karen E⋅Pollok, Karen⋅Pollok, Karen⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O and Meroueh, Samy O
ACS chemical biology, 2020-Apr-03. | Journal Article
 
Small-molecule covalent bond formation at tyrosine creates a binding site and inhibits activation of Ral GTPases
Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Liu, Degang⋅Liu, Degang⋅Gonzalez Gutierrez, Giovanni⋅Gonzalez-Gutierrez, Giovanni⋅Ghozayel, Mona K⋅Ghozayel, Mona K.⋅Xu, David⋅Xu, David⋅Meroueh, Samy O and Meroueh, Samy O.
Proceedings of the National Academy of Sciences of the United States of America, vol. 117, (no. 13), pp. 7139, 2020-Mar-31. | Journal Article
 
Small-Molecule Inhibition of the uPAR•uPA Interaction by Conformational Selection
Xu, David⋅Bum-Erdene, Khuchtumur⋅Leth, Julie M⋅Plough, Michael and Meroueh, Samy
ChemMedChem. | Journal Article
2019
Chemical Space Overlap with Critical Protein–Protein Interface Residues in Commercial and Specialized Small‐Molecule Libraries
Si, Yubing⋅Xu, David⋅Bum‐Erdene, Khuchtumur⋅Ghozayel, Mona K⋅Yang, Baocheng⋅Clemons, Paul A and Meroueh, Samy O
ChemMedChem, vol. 14, (no. 1), pp. 131, January 8, 2019. | Journal Article
 
Small-Molecule Covalent Modification of Conserved Cysteine Leads to Allosteric Inhibition of the TEAD⋅Yap Protein-Protein Interaction
Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Gonzalez-Gutierrez, Giovanni⋅Gonzalez-Gutierrez, Giovanni⋅Gonzalez-Gutierrez, Giovanni⋅Gonzalez-Gutierrez, Giovanni⋅Ghozayel, Mona K⋅Ghozayel, Mona K⋅Ghozayel, Mona K⋅Ghozayel, Mona K⋅Si, Yubing⋅Si, Yubing⋅Si, Yubing⋅Si, Yubing⋅Xu, David⋅Xu, David⋅Xu, David⋅Xu, David⋅Shannon, Harlan E⋅Shannon, Harlan E⋅Shannon, Harlan E⋅Shannon, Harlan E⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Bailey, Barbara J⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Corson, Timothy W⋅Pollok, Karen E⋅Pollok, Karen E⋅Pollok, Karen E⋅Pollok, Karen E⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Wells, Clark D⋅Meroueh, Samy O⋅Meroueh, Samy O⋅Meroueh, Samy O and Meroueh, Samy O
Cell Chemical Biology, vol. 26, (no. 3), pp. 389.e13, 2019-03-00. | Journal Article
2018
Small-molecule Ca V α 1 ⋅Ca V β antagonist suppresses neuronal voltage-gated calcium-channel trafficking
Chen, Xingjuan⋅Chen, Xingjuan⋅Liu, Degang⋅Liu, Degang⋅Zhou, Donghui⋅Zhou, Donghui⋅Si, Yubing⋅Si, Yubing⋅Xu, David⋅Xu, David⋅Stamatkin, Christopher W⋅Stamatkin, Christopher W⋅Ghozayel, Mona K⋅Ghozayel, Mona K⋅Ripsch, Matthew S⋅Ripsch, Matthew S⋅Obukhov, Alexander G⋅Obukhov, Alexander G⋅White, Fletcher A⋅White, Fletcher A⋅Meroueh, Samy O and Meroueh, Samy O
Proceedings of the National Academy of Sciences of the United States of America, vol. 115, (no. 45), pp. E10566, 2018-11-06. | Journal Article
 
Small-molecule CaVα1⋅CaVβ antagonist suppresses neuronal voltage-gated calcium-channel trafficking
Chen, Xingjuan⋅Chen, Xingjuan⋅Liu, Degang⋅Liu, Degang⋅Zhou, Donghui⋅Zhou, Donghui⋅Si, Yubing⋅Si, Yubing⋅Xu, David⋅Xu, David⋅Stamatkin, Christopher W⋅Stamatkin, Christopher W⋅Ghozayel, Mona K⋅Ghozayel, Mona K⋅Ripsch, Matthew S⋅Ripsch, Matthew S⋅Obukhov, Alexander G⋅Obukhov, Alexander G⋅White, Fletcher A⋅White, Fletcher A⋅Meroueh, Samy O and Meroueh, Samy O
Proceedings of the National Academy of Sciences, vol. 115, (no. 45), pp. E10575, 2018-11-06. | Journal Article
 
Small molecules inhibit ex vivo tumor growth in bone
Zhou, Donghui⋅Zhou, Donghui⋅Bum-Erdene, Khuchtumur⋅Bum-Erdene, Khuchtumur⋅Xu, David⋅Xu, David⋅Liu, Degang⋅Liu, Degang⋅Tompkins, Doug⋅Tompkins, Doug⋅Sulaiman, Rania S⋅Sulaiman, Rania S⋅Corson, Timothy W⋅Corson, Timothy W⋅Chirgwin, John M⋅Chirgwin, John M⋅Meroueh, Samy O and Meroueh, Samy O
Bioorganic & Medicinal Chemistry, vol. 26, (no. 23-24), pp. 6134, 2018-12-15. | Journal Article
2017
A Computational Investigation of Small-Molecule Engagement of Hot Spots at Protein-Protein Interaction Interfaces.
Xu, David⋅Si, Yubing and Meroueh, Samy O
Journal of chemical information and modeling, August 2, 2017. | Journal Article
 
Mimicking Intermolecular Interactions of Tight Protein–Protein Complexes for Small‐Molecule Antagonists
Xu, David⋅Bum‐Erdene, Khuchtumur⋅Si, Yubing⋅Zhou, Donghui⋅Ghozayel, Mona K and Meroueh, Samy O
ChemMedChem, vol. 12, (no. 21), pp. 1809, November 8, 2017. | Journal Article
 
Small Molecules Engage Hot Spots Through Cooperative Binding to Inhibit a Tight Protein-Protein Interaction.
Liu, Degang⋅Xu, David⋅Liu, Min⋅Knabe, William Eric⋅Yuan, Cai⋅Zhou, Donghui⋅Huang, Mingdong and Meroueh, Samy O
Biochemistry, February 10, 2017. | Journal Article
 
Small molecules inhibit STAT3 activation, autophagy, and cancer cell anchorage-independent growth
Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Springer, Maya Z⋅Springer, Maya Z⋅Springer, Maya Z⋅Xu, David⋅Xu, David⋅Xu, David⋅Liu, Degang⋅Liu, Degang⋅Liu, Degang⋅Hudmon, Andy⋅Hudmon, Andy⋅Hudmon, Andy⋅Macleod, Kay F⋅Macleod, Kay F⋅Macleod, Kay F⋅Meroueh, Samy O⋅Meroueh, Samy O and Meroueh, Samy O
Bioorganic & Medicinal Chemistry, vol. 25, (no. 12), pp. 3005, 2017-06-15. | Journal Article
 
Structure‐Based Target‐Specific Screening Leads to Small‐Molecule CaMKII Inhibitors
Xu, David⋅Xu, David⋅Xu, David⋅Li, Liwei⋅Li, Liwei⋅Li, Liwei⋅Zhou, Donghui⋅Zhou, Donghui⋅Zhou, Donghui⋅Liu, Degang⋅Liu, Degang⋅Liu, Degang⋅Hudmon, Andy⋅Hudmon, Andy⋅Hudmon, Andy⋅Meroueh, Samy O⋅Meroueh, Samy and Meroueh, Samy O
ChemMedChem, vol. 12, (no. 9), pp. 677, May 9, 2017. | Journal Article
2016
Effect of Binding Pose and Modeled Structures on SVMGen and GlideScore Enrichment of Chemical Libraries
Xu, David and Meroueh, Samy O
Journal of Chemical Information and Modeling, vol. 56, (no. 6), pp. 1151, 20160627. | Journal Article
 
Small-molecule binding sites to explore protein-protein interactions in the cancer proteome.
Xu, David⋅Jalal, Shadia I⋅Sledge, George W and Meroueh, Samy O
Molecular bioSystems, vol. 12, (no. 10), pp. 3067-3087, October 20, 2016. | Journal Article
2015
A new class of orthosteric uPAR·uPA small-molecule antagonists are allosteric inhibitors of the uPAR·vitronectin interaction.
Liu, Degang⋅Zhou, Donghui⋅Wang, Bo⋅Knabe, William Eric and Meroueh, Samy O
ACS chemical biology, vol. 10, (no. 6), pp. 1521-1534, June 19, 2015. | Journal Article
 
Structure-based computational approaches for small-molecule modulation of protein-protein interactions.
Xu, David⋅Wang, Bo and Meroueh, Samy O
Methods in molecular biology (Clifton, N.J.), vol. 1278, pp. 77-92, 2015. | Journal Article