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Results: 1 to 20 of 46

1.

Discovery of (E)-5-(benzylideneamino)-1H-benzo[d]imidazol-2(3H)-one derivatives as inhibitors for PTK6.

Shim HJ, Yang HR, Kim HI, Kang SA, No KT, Jung YH, Lee ST.

Bioorg Med Chem Lett. 2014 Aug 23. pii: S0960-894X(14)00880-4. doi: 10.1016/j.bmcl.2014.08.036. [Epub ahead of print]

PMID:
25205190
[PubMed - as supplied by publisher]
2.

An empirical model for gas phase acidity and basicity estimation.

You H, Kim GE, Na CH, Lee S, Lee CJ, Cho KH, Akiyama Y, Ishida T, No KT.

SAR QSAR Environ Res. 2014;25(2):91-115. doi: 10.1080/1062936X.2013.864997. Epub 2014 Mar 5.

PMID:
24597990
[PubMed - in process]
3.

Identification of novel rab27a/melanophilin blockers by pharmacophore-based virtual screening.

Joung JY, Lee HY, Park J, Lee JY, Chang BH, No KT, Nam KY, Hwang JS.

Appl Biochem Biotechnol. 2014 Feb;172(4):1882-97. doi: 10.1007/s12010-013-0615-2. Epub 2013 Nov 30.

PMID:
24293275
[PubMed - in process]
4.

Human nephrotoxicity prediction models for three types of kidney injury based on data sets of pharmacological compounds and their metabolites.

Lee S, Kang YM, Park H, Dong MS, Shin JM, No KT.

Chem Res Toxicol. 2013 Nov 18;26(11):1652-9. doi: 10.1021/tx400249t. Epub 2013 Nov 5.

PMID:
24138086
[PubMed - indexed for MEDLINE]
5.

A generalized G-SFED continuum solvation free energy calculation model.

Lee S, Cho KH, Kang YM, Scheraga HA, No KT.

Proc Natl Acad Sci U S A. 2013 Feb 19;110(8):E662-7. doi: 10.1073/pnas.1221940110. Epub 2013 Feb 1.

PMID:
23378634
[PubMed - indexed for MEDLINE]
Free PMC Article
6.

Structure-based design and synthesis of C-1- and C-4-modified analogs of zanamivir as neuraminidase inhibitors.

Feng E, Shin WJ, Zhu X, Li J, Ye D, Wang J, Zheng M, Zuo JP, No KT, Liu X, Zhu W, Tang W, Seong BL, Jiang H, Liu H.

J Med Chem. 2013 Feb 14;56(3):671-84. doi: 10.1021/jm3009713. Epub 2013 Jan 30.

PMID:
23330908
[PubMed - indexed for MEDLINE]
7.

Synthesis of C-4-modified zanamivir analogs as neuraminidase inhibitors and their anti-AIV activities.

Ye D, Shin WJ, Li N, Tang W, Feng E, Li J, He PL, Zuo JP, Kim H, Nam KY, Zhu W, Seong BL, No KT, Jiang H, Liu H.

Eur J Med Chem. 2012 Aug;54:764-70. doi: 10.1016/j.ejmech.2012.06.033. Epub 2012 Jun 29.

PMID:
22795831
[PubMed - indexed for MEDLINE]
8.

PXR ligand classification model with SFED-weighted WHIM and CoMMA descriptors.

Ma SL, Joung JY, Lee S, Cho KH, No KT.

SAR QSAR Environ Res. 2012 Jul;23(5-6):485-504. doi: 10.1080/1062936X.2012.665385. Epub 2012 May 16.

PMID:
22591167
[PubMed - indexed for MEDLINE]
9.

Hypnotic effects and GABAergic mechanism of licorice (Glycyrrhiza glabra) ethanol extract and its major flavonoid constituent glabrol.

Cho S, Park JH, Pae AN, Han D, Kim D, Cho NC, No KT, Yang H, Yoon M, Lee C, Shimizu M, Baek NI.

Bioorg Med Chem. 2012 Jun 1;20(11):3493-501. doi: 10.1016/j.bmc.2012.04.011. Epub 2012 Apr 11.

PMID:
22543233
[PubMed - indexed for MEDLINE]
10.

Ligand aligning method for molecular docking: alignment of property-weighted vectors.

Joung JY, Nam KY, Cho KH, No KT.

J Chem Inf Model. 2012 Apr 23;52(4):984-95. doi: 10.1021/ci200501p. Epub 2012 Apr 13.

PMID:
22471323
[PubMed - indexed for MEDLINE]
11.

yaInChI: modified InChI string scheme for line notation of chemical structures.

Cho YS, No KT, Cho KH.

SAR QSAR Environ Res. 2012;23(3-4):237-55. doi: 10.1080/1062936X.2012.657677. Epub 2012 Apr 2.

PMID:
22468774
[PubMed - indexed for MEDLINE]
12.

Development of surface-SFED models for polar solvents.

Lee S, Cho KH, Acree WE, No KT.

J Chem Inf Model. 2012 Feb 27;52(2):440-8. doi: 10.1021/ci2004913. Epub 2012 Feb 1.

PMID:
22242933
[PubMed]
13.

Ligand supported homology modeling and docking evaluation of CCR2: docked pose selection by consensus scoring.

Kim JH, Lim JW, Lee SW, Kim K, No KT.

J Mol Model. 2011 Oct;17(10):2707-16. doi: 10.1007/s00894-010-0943-x. Epub 2011 Jan 7.

PMID:
21213000
[PubMed - indexed for MEDLINE]
14.

Calculation of the solvation free energy of neutral and ionic molecules in diverse solvents.

Lee S, Cho KH, Lee CJ, Kim GE, Na CH, In Y, No KT.

J Chem Inf Model. 2011 Jan 24;51(1):105-14. doi: 10.1021/ci100299m. Epub 2010 Dec 6.

PMID:
21133372
[PubMed - indexed for MEDLINE]
15.

Structure-based virtual screening of novel tubulin inhibitors and their characterization as anti-mitotic agents.

Kim ND, Park ES, Kim YH, Moon SK, Lee SS, Ahn SK, Yu DY, No KT, Kim KH.

Bioorg Med Chem. 2010 Oct 1;18(19):7092-100. doi: 10.1016/j.bmc.2010.07.072. Epub 2010 Aug 6.

PMID:
20810285
[PubMed - indexed for MEDLINE]
16.

Improving gene expression similarity measurement using pathway-based analytic dimension.

Keum C, Woo JH, Oh WS, Park SN, No KT.

BMC Genomics. 2009 Dec 3;10 Suppl 3:S15. doi: 10.1186/1471-2164-10-S3-S15.

PMID:
19958478
[PubMed - indexed for MEDLINE]
Free PMC Article
17.

A robust method for searching the smallest set of smallest rings with a path-included distance matrix.

Lee CJ, Kang YM, Cho KH, No KT.

Proc Natl Acad Sci U S A. 2009 Oct 13;106(41):17355-8. doi: 10.1073/pnas.0813040106. Epub 2009 Sep 24. Erratum in: Proc Natl Acad Sci U S A. 2009 Nov 17;106(46):19629.

PMID:
19805142
[PubMed - indexed for MEDLINE]
Free PMC Article
18.

EaMEAD: Activation energy prediction of cytochrome P450 mediated metabolism with effective atomic descriptors.

Kim DN, Cho KH, Oh WS, Lee CJ, Lee SK, Jung J, No KT.

J Chem Inf Model. 2009 Jul;49(7):1643-54. doi: 10.1021/ci900011g.

PMID:
19545128
[PubMed - indexed for MEDLINE]
19.

Identification of novel inhibitors of HCV RNA-dependent RNA polymerase by pharmacophore-based virtual screening and in vitro evaluation.

Ryu K, Kim ND, Choi SI, Han CK, Yoon JH, No KT, Kim KH, Seong BL.

Bioorg Med Chem. 2009 Apr 15;17(8):2975-82. doi: 10.1016/j.bmc.2009.03.024. Epub 2009 Mar 18.

PMID:
19332375
[PubMed - indexed for MEDLINE]
20.

Classification models for CYP450 3A4 inhibitors and non-inhibitors.

Choi I, Kim SY, Kim H, Kang NS, Bae MA, Yoo SE, Jung J, No KT.

Eur J Med Chem. 2009 Jun;44(6):2354-60. doi: 10.1016/j.ejmech.2008.08.013. Epub 2008 Sep 18.

PMID:
19026469
[PubMed - indexed for MEDLINE]

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