| Year |
Citation |
Score |
| 2021 |
Cate RL, di Clemente N, Racine C, Groome NP, Pepinsky RB, Whitty A. The anti-Müllerian hormone prodomain is displaced from the hormone/prodomain complex upon bivalent binding to the hormone receptor. The Journal of Biological Chemistry. 298: 101429. PMID 34801555 DOI: 10.1016/j.jbc.2021.101429 |
0.378 |
|
| 2020 |
Wakefield AE, Yueh C, Beglov D, Castilho MS, Kozakov D, Keserű GM, Whitty A, Vajda S. Benchmark Sets for Binding Hot Spot Identification in Fragment-Based Ligand Discovery. Journal of Chemical Information and Modeling. PMID 33291870 DOI: 10.1021/acs.jcim.0c00877 |
0.377 |
|
| 2020 |
Pyeatt G, Muellers S, Whitty A, Allen KN. Structural Characterization of the Covalent Binding of Keap1 and Thiol‐containing Small Molecules The Faseb Journal. 34: 1-1. DOI: 10.1096/Fasebj.2020.34.S1.07357 |
0.424 |
|
| 2019 |
Zhong M, Lynch AJ, Muellers SN, Jehle S, Luo L, Hall DR, Iwase R, Carolan JP, Egbert M, Wakefield A, Streu K, Harvey CM, Ortet PC, Kozakov D, Vajda S, ... ... Whitty A, et al. Interaction Energetics and Druggability of the Protein-Protein Interaction between Kelch-like ECH-associated Protein 1 (KEAP1) and Nuclear Factor, Erythroid 2 Like 2 (Nrf2). Biochemistry. PMID 31851823 DOI: 10.1021/Acs.Biochem.9B00943 |
0.503 |
|
| 2019 |
Yueh C, Rettenmaier J, Xia B, Hall DR, Alekseenko A, Porter KA, Barkovich K, Keseru G, Whitty A, Wells JA, Vajda S, Kozakov D. Kinase Atlas: Druggability Analysis of Potential Allosteric Sites in Kinases. Journal of Medicinal Chemistry. PMID 31274316 DOI: 10.1021/Acs.Jmedchem.9B00089 |
0.362 |
|
| 2019 |
Egbert M, Whitty A, Keseru GM, Vajda S. Why some targets benefit from beyond rule of five drugs. Journal of Medicinal Chemistry. PMID 31188592 DOI: 10.1021/Acs.Jmedchem.8B01732 |
0.358 |
|
| 2019 |
Shaffer R, DeMaria AH, Kagermazova L, Liu Y, Babaei M, Penix S, Cervantes A, Jehle S, Makowski L, Gilmore TD, Whitty A, Allen KN. A Central Region of NEMO is Required for IKKβ-Induced Conformational Change and for Signal Propagation. Biochemistry. PMID 31145594 DOI: 10.1021/Acs.Biochem.8B01316 |
0.428 |
|
| 2018 |
Vajda S, Beglov D, Wakefield AE, Egbert M, Whitty A. Cryptic binding sites on proteins: definition, detection, and druggability. Current Opinion in Chemical Biology. 44: 1-8. PMID 29800865 DOI: 10.1016/J.Cbpa.2018.05.003 |
0.46 |
|
| 2018 |
Beglov D, Hall DR, Wakefield AE, Luo L, Allen KN, Kozakov D, Whitty A, Vajda S. Exploring the structural origins of cryptic sites on proteins. Proceedings of the National Academy of Sciences of the United States of America. PMID 29581267 DOI: 10.1073/Pnas.1711490115 |
0.442 |
|
| 2017 |
Mukherjee H, Debreczeni J, Breed J, Tentarelli S, Aquila B, Dowling JE, Whitty A, Grimster NP. A study of the reactivity of S((VI))-F containing warheads with nucleophilic amino-acid side chains under physiological conditions. Organic & Biomolecular Chemistry. PMID 29119993 DOI: 10.1039/C7Ob02028G |
0.364 |
|
| 2017 |
Whitty A, Viarengo LA, Zhong M. Progress towards the broad use of non-peptide synthetic macrocycles in drug discovery. Organic & Biomolecular Chemistry. PMID 28876025 DOI: 10.1039/C7Ob00056A |
0.364 |
|
| 2015 |
Hall DR, Kozakov D, Whitty A, Vajda S. Lessons from Hot Spot Analysis for Fragment-Based Drug Discovery. Trends in Pharmacological Sciences. 36: 724-36. PMID 26538314 DOI: 10.1016/J.Tips.2015.08.003 |
0.431 |
|
| 2015 |
Vajda S, Whitty A, Kozakov D. Fragments and hot spots in drug discovery. Oncotarget. 6: 18740-1. PMID 26300051 DOI: 10.18632/Oncotarget.4968 |
0.491 |
|
| 2015 |
Kozakov D, Hall DR, Napoleon RL, Yueh C, Whitty A, Vajda S. New Frontiers in Druggability. Journal of Medicinal Chemistry. PMID 26230724 DOI: 10.1021/Acs.Jmedchem.5B00586 |
0.343 |
|
| 2015 |
Whitty A, Zhou L. Horses for courses: reaching outside drug-like chemical space for inhibitors of challenging drug targets. Future Medicinal Chemistry. 7: 1093-5. PMID 26132520 DOI: 10.4155/Fmc.15.56 |
0.497 |
|
| 2015 |
Kozakov D, Hall DR, Jehle S, Luo L, Ochiana SO, Jones EV, Pollastri M, Allen KN, Whitty A, Vajda S. Ligand deconstruction: Why some fragment binding positions are conserved and others are not. Proceedings of the National Academy of Sciences of the United States of America. 112: E2585-94. PMID 25918377 DOI: 10.1073/Pnas.1501567112 |
0.493 |
|
| 2015 |
Yeo AT, Chennamadhavuni S, Whitty A, Porco JA, Gilmore TD. Inhibition of Oncogenic Transcription Factor REL by the Natural Product Derivative Calafianin Monomer 101 Induces Proliferation Arrest and Apoptosis in Human B-Lymphoma Cell Lines. Molecules (Basel, Switzerland). 20: 7474-94. PMID 25915462 DOI: 10.3390/Molecules20057474 |
0.347 |
|
| 2015 |
Li S, Bhave D, Chow JM, Riera TV, Schlee S, Rauch S, Atanasova M, Cate RL, Whitty A. Quantitative analysis of receptor tyrosine kinase-effector coupling at functionally relevant stimulus levels. The Journal of Biological Chemistry. 290: 10018-36. PMID 25635057 DOI: 10.1074/Jbc.M114.602268 |
0.3 |
|
| 2015 |
Atanasova M, Whitty A. Activation of the RET Receptor Tyrosine Kinase by Agonist Antibodies Results in Distinct Signaling Effects The Faseb Journal. 29. DOI: 10.1096/Fasebj.29.1_Supplement.728.44 |
0.393 |
|
| 2015 |
Kozakov D, Hall DR, Jehle S, Luo L, Ochiana SO, Jones EV, Pollastri M, Allen KN, Whitty A, Vajda S. Correction for "Ligand deconstruction: Why some fragment binding positions are conserved and others are not," Proceedings of the National Academy of Sciences of the United States of America. 112: E3749. DOI: 10.1073/pnas.1511466112 |
0.319 |
|
| 2014 |
Zhou L, Yeo AT, Ballarano C, Weber U, Allen KN, Gilmore TD, Whitty A. Disulfide-mediated stabilization of the IκB kinase binding domain of NF-κB essential modulator (NEMO). Biochemistry. 53: 7929-44. PMID 25400026 DOI: 10.1021/Bi500920N |
0.567 |
|
| 2014 |
Villar EA, Beglov D, Chennamadhavuni S, Porco JA, Kozakov D, Vajda S, Whitty A. How proteins bind macrocycles. Nature Chemical Biology. 10: 723-31. PMID 25038790 DOI: 10.1038/Nchembio.1584 |
0.464 |
|
| 2013 |
Cote SM, Gilmore TD, Shaffer R, Weber U, Bollam R, Golden MS, Glover K, Herscovitch M, Ennis T, Allen KN, Whitty A. Mutation of nonessential cysteines shows that the NF-κB essential modulator forms a constitutive noncovalent dimer that binds IκB kinase-β with high affinity. Biochemistry. 52: 9141-54. PMID 24266532 DOI: 10.1021/Bi401368R |
0.74 |
|
| 2013 |
Day ES, Capili AD, Borysenko CW, Zafari M, Whitty A. Determining the affinity and stoichiometry of interactions between unmodified proteins in solution using Biacore. Analytical Biochemistry. 440: 96-107. PMID 23711722 DOI: 10.1016/J.Ab.2013.05.012 |
0.495 |
|
| 2013 |
Golden MS, Cote SM, Sayeg M, Zerbe BS, Villar EA, Beglov D, Sazinsky SL, Georgiadis RM, Vajda S, Kozakov D, Whitty A. Comprehensive experimental and computational analysis of binding energy hot spots at the NF-κB essential modulator/IKKβ protein-protein interface. Journal of the American Chemical Society. 135: 6242-56. PMID 23506214 DOI: 10.1021/Ja400914Z |
0.741 |
|
| 2012 |
Day ES, Cote SM, Whitty A. Binding efficiency of protein-protein complexes. Biochemistry. 51: 9124-36. PMID 23088250 DOI: 10.1021/Bi301039T |
0.744 |
|
| 2012 |
Atanasova M, Whitty A. Understanding cytokine and growth factor receptor activation mechanisms. Critical Reviews in Biochemistry and Molecular Biology. 47: 502-30. PMID 23046381 DOI: 10.3109/10409238.2012.729561 |
0.357 |
|
| 2012 |
Zerbe BS, Hall DR, Vajda S, Whitty A, Kozakov D. Relationship between hot spot residues and ligand binding hot spots in protein-protein interfaces. Journal of Chemical Information and Modeling. 52: 2236-44. PMID 22770357 DOI: 10.1021/Ci300175U |
0.516 |
|
| 2011 |
Kozakov D, Hall DR, Chuang GY, Cencic R, Brenke R, Grove LE, Beglov D, Pelletier J, Whitty A, Vajda S. Structural conservation of druggable hot spots in protein-protein interfaces. Proceedings of the National Academy of Sciences of the United States of America. 108: 13528-33. PMID 21808046 DOI: 10.1073/Pnas.1101835108 |
0.476 |
|
| 2011 |
Silvian LF, Friedman JE, Strauch K, Cachero TG, Day ES, Qian F, Cunningham B, Fung A, Sun L, Shipps GW, Su L, Zheng Z, Kumaravel G, Whitty A. Small molecule inhibition of the TNF family cytokine CD40 ligand through a subunit fracture mechanism. Acs Chemical Biology. 6: 636-47. PMID 21417339 DOI: 10.1021/Cb2000346 |
0.496 |
|
| 2010 |
di Clemente N, Jamin SP, Lugovskoy A, Carmillo P, Ehrenfels C, Picard JY, Whitty A, Josso N, Pepinsky RB, Cate RL. Processing of anti-mullerian hormone regulates receptor activation by a mechanism distinct from TGF-beta. Molecular Endocrinology (Baltimore, Md.). 24: 2193-206. PMID 20861221 DOI: 10.1210/Me.2010-0273 |
0.452 |
|
| 2009 |
Arkin MR, Whitty A. The road less traveled: modulating signal transduction enzymes by inhibiting their protein-protein interactions. Current Opinion in Chemical Biology. 13: 284-90. PMID 19553156 DOI: 10.1016/J.Cbpa.2009.05.125 |
0.381 |
|
| 2008 |
Whitty A. Cooperativity and biological complexity. Nature Chemical Biology. 4: 435-9. PMID 18641616 DOI: 10.1038/Nchembio0808-435 |
0.348 |
|
| 2008 |
Whitty A, Riera TV. New ways to target old receptors. Current Opinion in Chemical Biology. 12: 427-33. PMID 18570899 DOI: 10.1016/J.Cbpa.2008.05.014 |
0.331 |
|
| 2006 |
Schlee S, Carmillo P, Whitty A. Quantitative analysis of the activation mechanism of the multicomponent growth-factor receptor Ret. Nature Chemical Biology. 2: 636-44. PMID 17013378 DOI: 10.1038/Nchembio823 |
0.369 |
|
| 2006 |
Cachero TG, Schwartz IM, Qian F, Day ES, Bossen C, Ingold K, Tardivel A, Krushinskie D, Eldredge J, Silvian L, Lugovskoy A, Farrington GK, Strauch K, Schneider P, Whitty A. Formation of virus-like clusters is an intrinsic property of the tumor necrosis factor family member BAFF (B cell activating factor). Biochemistry. 45: 2006-13. PMID 16475789 DOI: 10.1021/Bi051685O |
0.32 |
|
| 2005 |
Carmillo P, Dagø L, Day ES, Worley DS, Rossomando A, Walus L, Orozco O, Buckley C, Miller S, Tse A, Cate RL, Rosenblad C, Sah DW, Grønborg M, Whitty A. Glial cell line-derived neurotrophic factor (GDNF) receptor alpha-1 (GFR alpha 1) is highly selective for GDNF versus artemin. Biochemistry. 44: 2545-54. PMID 15709767 DOI: 10.1021/Bi049247P |
0.42 |
|
| 2005 |
Day ES, Cachero TG, Qian F, Sun Y, Wen D, Pelletier M, Hsu YM, Whitty A. Selectivity of BAFF/BLyS and APRIL for binding to the TNF family receptors BAFFR/BR3 and BCMA. Biochemistry. 44: 1919-31. PMID 15697217 DOI: 10.1021/Bi048227K |
0.495 |
|
| 2003 |
Rawat R, Whitty A, Tonge PJ. The isoniazid-NAD adduct is a slow, tight-binding inhibitor of InhA, the Mycobacterium tuberculosis enoyl reductase: adduct affinity and drug resistance. Proceedings of the National Academy of Sciences of the United States of America. 100: 13881-6. PMID 14623976 DOI: 10.1073/Pnas.2235848100 |
0.42 |
|
| 2003 |
Pelletier M, Thompson JS, Qian F, Bixler SA, Gong D, Cachero T, Gilbride K, Day E, Zafari M, Benjamin C, Gorelik L, Whitty A, Kalled SL, Ambrose C, Hsu YM. Comparison of soluble decoy IgG fusion proteins of BAFF-R and BCMA as antagonists for BAFF. The Journal of Biological Chemistry. 278: 33127-33. PMID 12796483 DOI: 10.1074/Jbc.M305754200 |
0.325 |
|
| 2002 |
Day ES, Osborn L, Whitty A. Effect of divalent cations on the affinity and selectivity of alpha4 integrins towards the integrin ligands vascular cell adhesion molecule-1 and mucosal addressin cell adhesion molecule-1: Ca2+ activation of integrin alpha4beta1 confers a distinct ligand specificity. Cell Communication & Adhesion. 9: 205-19. PMID 12699089 DOI: 10.1080/15419060216014 |
0.473 |
|
| 2002 |
Bell AF, Feng Y, Hofstein HA, Parikh S, Wu J, Rudolph MJ, Kisker C, Whitty A, Tonge PJ. Stereoselectivity of enoyl-CoA hydratase results from preferential activation of one of two bound substrate conformers. Chemistry & Biology. 9: 1247-55. PMID 12445775 DOI: 10.1016/S1074-5521(02)00263-6 |
0.316 |
|
| 2002 |
Pepinsky RB, Mumford RA, Chen LL, Leone D, Amo SE, Riper GV, Whitty A, Dolinski B, Lobb RR, Dean DC, Chang LL, Raab CE, Si Q, Hagmann WK, Lingham RB. Comparative assessment of the ligand and metal ion binding properties of integrins alpha9beta1 and alpha4beta1. Biochemistry. 41: 7125-41. PMID 12033947 DOI: 10.1021/bi020024d |
0.341 |
|
| 2001 |
Runkel L, De Dios C, Karpusas M, Baker D, Li Z, Zafari M, Betzenhauser M, Muldowney C, Miller S, Redlich PN, Grossberg SE, Whitty A, Hochman PS. Mapping of IFN-beta epitopes important for receptor binding and biologic activation: comparison of results achieved using antibody-based methods and alanine substitution mutagenesis. Journal of Interferon & Cytokine Research : the Official Journal of the International Society For Interferon and Cytokine Research. 21: 931-41. PMID 11747625 DOI: 10.1089/107999001753289541 |
0.456 |
|
| 2001 |
Bromley SK, Iaboni A, Davis SJ, Whitty A, Green JM, Shaw AS, Weiss A, Dustin ML. The immunological synapse and CD28-CD80 interactions. Nature Immunology. 2: 1159-66. PMID 11713465 DOI: 10.1038/Ni737 |
0.304 |
|
| 2001 |
Ling Chen L, Whitty A, Scott D, Lee WC, Cornebise M, Adams SP, Petter RC, Lobb RR, Pepinsky RB. Evidence That Ligand and Metal Ion Binding to Integrin α 4β1 Are Regulated through a Coupled Equilibrium Journal of Biological Chemistry. 276: 36520-36529. PMID 11473127 DOI: 10.1074/Jbc.M106216200 |
0.413 |
|
| 2001 |
Taylor FR, Wen D, Garber EA, Carmillo AN, Baker DP, Arduini RM, Williams KP, Weinreb PH, Rayhorn P, Hronowski X, Whitty A, Day ES, Boriack-Sjodin A, Shapiro RI, Galdes A, et al. Enhanced potency of human Sonic hedgehog by hydrophobic modification Biochemistry. 40: 4359-4371. PMID 11284692 DOI: 10.1021/Bi002487U |
0.379 |
|
| 2000 |
Runkel L, deDios C, Karpusas M, Betzenhauser M, Muldowney C, Zafari M, Benjamin CD, Miller S, Hochman PS, Whitty A. Systematic mutational mapping of sites on human interferon-beta-1a that are important for receptor binding and functional activity. Biochemistry. 39: 2538-51. PMID 10704203 DOI: 10.1021/Bi991631C |
0.466 |
|
| 1999 |
Majeau GR, Whitty A, Yim K, Meier W, Hochman PS. Low affinity binding of an LFA-3/IgG1 fusion protein to CD2+ T cells is independent of cell activation Cell Adhesion and Communication. 7: 267-279. PMID 10626910 DOI: 10.3109/15419069909010808 |
0.446 |
|
| 1999 |
Day ES, Wen D, Garber EA, Hong J, Avedissian LS, Rayhorn P, Shen W, Zeng C, Bailey VR, Reilly JO, Roden JA, Moore CB, Williams KP, Galdes A, Whitty A, et al. Zinc-dependent structural stability of human sonic hedgehog Biochemistry. 38: 14868-14880. PMID 10555969 DOI: 10.1021/Bi9910068 |
0.362 |
|
| 1999 |
Chen LL, Whitty A, Lobb RR, Adams SP, Pepinsky RB. Multiple activation states of integrin α4β1 detected through their different affinities for a small molecule ligand Journal of Biological Chemistry. 274: 13167-13175. PMID 10224072 DOI: 10.1074/Jbc.274.19.13167 |
0.437 |
|
| 1999 |
Taylor FR, Bixler SA, Budman JI, Wen D, Karpusas M, Ryan ST, Jaworski GJ, Safari-Fard A, Pollard S, Whitty A. Induced fit activation mechanism of the exceptionally specific serine protease, complement factor D. Biochemistry. 38: 2849-59. PMID 10052957 DOI: 10.1021/Bi982140F |
0.356 |
|
| 1999 |
Whitty A, Borysenko CW. Small molecule cytokine mimetics Chemistry and Biology. 6. DOI: 10.1016/S1074-5521(99)80034-9 |
0.31 |
|
| 1998 |
Nash P, Whitty A, Handwerker J, Macen J, McFadden G. Inhibitory specificity of the anti-inflammatory myxoma virus serpin, SERP-1 Journal of Biological Chemistry. 273: 20982-20991. PMID 9694848 DOI: 10.1074/Jbc.273.33.20982 |
0.329 |
|
| 1997 |
Sanicola M, Hession C, Worley D, Carmillo P, Ehrenfels C, Walus L, Robinson S, Jaworski G, Wei H, Tizard R, Whitty A, Pepinsky RB, Cate RL. Glial cell line-derived neurotrophic factor-dependent RET activation can be mediated by two different cell-surface accessory proteins Proceedings of the National Academy of Sciences of the United States of America. 94: 6238-6243. PMID 9177201 DOI: 10.1073/Pnas.94.12.6238 |
0.416 |
|
| 1995 |
Lobb RR, Antognetti G, Pepinsky RB, Burkly LC, Leone DR, Whitty A. A direct binding assay for the vascular cell adhesion molecule-1 (VCAM1) interaction with α4 integrins Cell Communication and Adhesion. 3: 385-397. PMID 8640376 DOI: 10.3109/15419069509081293 |
0.402 |
|
| 1995 |
Whitty A, Fierke CA, Jencks WP. Role of binding energy with coenzyme A in catalysis by 3-oxoacid coenzyme A transferase. Biochemistry. 34: 11678-89. PMID 7547900 DOI: 10.1021/Bi00037A005 |
0.684 |
|
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