Skip to main page content
Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation

Search Page

My NCBI Filters
Text availability
Article attribute
Article type
Publication date

Search Results

200 results
Filters applied: . Clear all Results are displayed in a computed author sort order. Results by year timeline is unavailable
Page 1
Orphan nuclear receptors as drug targets for the treatment of prostate and breast cancers.
Roshan-Moniri M, Hsing M, Butler MS, Cherkasov A, Rennie PS. Roshan-Moniri M, et al. Among authors: cherkasov a. Cancer Treat Rev. 2014 Dec;40(10):1137-52. doi: 10.1016/j.ctrv.2014.10.005. Cancer Treat Rev. 2014. PMID: 25455729 Review.
Nuclear receptors (NRs), a family of 48 transcriptional factors, have been studied intensively for their roles in cancer development and progression. ...In particular, a number of drugs have been developed over the years to target human androgen- and estrogen recept …
Nuclear receptors (NRs), a family of 48 transcriptional factors, have been studied intensively for their roles in cancer development …
Best Practices of Computer-Aided Drug Discovery: Lessons Learned from the Development of a Preclinical Candidate for Prostate Cancer with a New Mechanism of Action.
Ban F, Dalal K, Li H, LeBlanc E, Rennie PS, Cherkasov A. Ban F, et al. Among authors: cherkasov a. J Chem Inf Model. 2017 May 22;57(5):1018-1028. doi: 10.1021/acs.jcim.7b00137. Epub 2017 May 4. J Chem Inf Model. 2017. PMID: 28441481
This Perspective describes a real case of a drug discovery campaign accomplished in a relatively short time with limited resources. The study integrated an arsenal of available molecular modeling techniques with an array of experimental tools to successfully …
This Perspective describes a real case of a drug discovery campaign accomplished in a relatively short time with limite …
Bypassing Drug Resistance Mechanisms of Prostate Cancer with Small Molecules that Target Androgen Receptor-Chromatin Interactions.
Dalal K, Che M, Que NS, Sharma A, Yang R, Lallous N, Borgmann H, Ozistanbullu D, Tse R, Ban F, Li H, Tam KJ, Roshan-Moniri M, LeBlanc E, Gleave ME, Gewirth DT, Dehm SM, Cherkasov A, Rennie PS. Dalal K, et al. Among authors: cherkasov a. Mol Cancer Ther. 2017 Oct;16(10):2281-2291. doi: 10.1158/1535-7163.MCT-17-0259. Epub 2017 Aug 3. Mol Cancer Ther. 2017. PMID: 28775145 Free PMC article.
Human androgen receptor (AR) is a hormone-activated transcription factor that is an important drug target in the treatment of prostate cancer. ...We have also performed a series of experiments that revealed that genome-wide chromatin binding of AR was dramatically i …
Human androgen receptor (AR) is a hormone-activated transcription factor that is an important drug target in the treatment of prostat …
Androgen receptor plasticity and its implications for prostate cancer therapy.
Snow O, Lallous N, Singh K, Lack N, Rennie P, Cherkasov A. Snow O, et al. Among authors: cherkasov a. Cancer Treat Rev. 2019 Dec;81:101871. doi: 10.1016/j.ctrv.2019.05.001. Epub 2019 Jun 11. Cancer Treat Rev. 2019. PMID: 31698174 Review.
Acquired resistance to a drug treatment is a common problem across many cancers including prostate cancer (PCa) - one of the major factors for male mortality. ...Despite the AR being one of the most studied and attended targets in cancer, those gain-of-function muta …
Acquired resistance to a drug treatment is a common problem across many cancers including prostate cancer (PCa) - one of the m …
Computer-Aided Ligand Discovery for Estrogen Receptor Alpha.
Bafna D, Ban F, Rennie PS, Singh K, Cherkasov A. Bafna D, et al. Among authors: cherkasov a. Int J Mol Sci. 2020 Jun 12;21(12):4193. doi: 10.3390/ijms21124193. Int J Mol Sci. 2020. PMID: 32545494 Free PMC article. Review.
Deep Docking: A Deep Learning Platform for Augmentation of Structure Based Drug Discovery.
Gentile F, Agrawal V, Hsing M, Ton AT, Ban F, Norinder U, Gleave ME, Cherkasov A. Gentile F, et al. Among authors: cherkasov a. ACS Cent Sci. 2020 Jun 24;6(6):939-949. doi: 10.1021/acscentsci.0c00229. Epub 2020 May 19. ACS Cent Sci. 2020. PMID: 32607441 Free PMC article.
Discovery of 1H-indole-2-carboxamides as novel inhibitors of the androgen receptor binding function 3 (BF3).
Ban F, Leblanc E, Li H, Munuganti RS, Frewin K, Rennie PS, Cherkasov A. Ban F, et al. Among authors: cherkasov a. J Med Chem. 2014 Aug 14;57(15):6867-72. doi: 10.1021/jm500684r. Epub 2014 Jul 25. J Med Chem. 2014. PMID: 25025737
A library of 1H-indole-2-carboxamides were discovered as BF3 inhibitors and exhibited strong antiproliferative activity against LNCaP and enzalutamide-resistant prostate cancer cell lines. Several of the lead compounds may prove of particular benefit as a novel alte
A library of 1H-indole-2-carboxamides were discovered as BF3 inhibitors and exhibited strong antiproliferative activity against LNCaP
Indel-based targeting of essential proteins in human pathogens that have close host orthologue(s): discovery of selective inhibitors for Leishmania donovani elongation factor-1alpha.
Nandan D, Lopez M, Ban F, Huang M, Li Y, Reiner NE, Cherkasov A. Nandan D, et al. Among authors: cherkasov a. Proteins. 2007 Apr 1;67(1):53-64. doi: 10.1002/prot.21278. Proteins. 2007. PMID: 17243179
Leishmania EF-1alpha is 82% identical to the corresponding human orthologue, but possesses a 12 aminoacid sequence deletion compared with human EF-1alpha. ...More generally, these findings provide a basis for a novel drug design platform. This platform target …
Leishmania EF-1alpha is 82% identical to the corresponding human orthologue, but possesses a 12 aminoacid sequence deletion compared …
An updated steroid benchmark set and its application in the discovery of novel nanomolar ligands of sex hormone-binding globulin.
Cherkasov A, Ban F, Santos-Filho O, Thorsteinson N, Fallahi M, Hammond GL. Cherkasov A, et al. J Med Chem. 2008 Apr 10;51(7):2047-56. doi: 10.1021/jm7011485. Epub 2008 Mar 11. J Med Chem. 2008. PMID: 18330978
A benchmark data set of steroids with known affinity for sex hormone-binding globulin (SHBG) has been widely used to validate popular molecular field-based QSAR techniques. We have expanded the data set by adding a number of nonsteroidal SHBG ligands identified both
A benchmark data set of steroids with known affinity for sex hormone-binding globulin (SHBG) has been widely used to validate popular
Using molecular docking, 3D-QSAR, and cluster analysis for screening structurally diverse data sets of pharmacological interest.
Santos-Filho OA, Cherkasov A. Santos-Filho OA, et al. Among authors: cherkasov a. J Chem Inf Model. 2008 Oct;48(10):2054-65. doi: 10.1021/ci8001952. Epub 2008 Sep 24. J Chem Inf Model. 2008. PMID: 18816024
In this study, we propose a drug design approach which includes docking, molecular fingerprints based cluster analysis, and 'induced' descriptors based receptor-dependent 3D-QSAR. ...The resulting models were interpretable; the constructed QSAR equations have high statisti …
In this study, we propose a drug design approach which includes docking, molecular fingerprints based cluster analysis, and 'induced' …
200 results
Jump to page
Feedback