Detalhe da pesquisa
1.
Machine Learning Models to Predict Inhibition of the Bile Salt Export Pump.
J Chem Inf Model
; 61(2): 587-602, 2021 02 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-33502191
2.
Molecular mechanism of action of pharmacoperone rescue of misrouted GPCR mutants: the GnRH receptor.
Mol Endocrinol
; 23(2): 157-68, 2009 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-19095769
3.
Rethinking drug design in the artificial intelligence era.
Nat Rev Drug Discov
; 19(5): 353-364, 2020 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-31801986
4.
3,4-Disubstituted benzofuran P1' MMP-13 inhibitors: optimization of selectivity and reduction of protein binding.
Bioorg Med Chem Lett
; 19(16): 4546-50, 2009 Aug 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-19625186
5.
Development of MK-8353, an orally administered ERK1/2 inhibitor, in patients with advanced solid tumors.
JCI Insight
; 3(4)2018 02 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-29467321
6.
A shape-based 3-D scaffold hopping method and its application to a bacterial protein-protein interaction.
J Med Chem
; 48(5): 1489-95, 2005 Mar 10.
Artigo
em Inglês
| MEDLINE | ID: mdl-15743191
7.
The application of x-ray, NMR, and molecular modeling in the design of MMP inhibitors.
Curr Top Med Chem
; 4(12): 1311-27, 2004.
Artigo
em Inglês
| MEDLINE | ID: mdl-15320728
8.
Efficient identification of novel leads by dynamic focused screening: PDK1 case stud.
Comb Chem High Throughput Screen
; 13(1): 16-26, 2010 Jan.
Artigo
em Inglês
| MEDLINE | ID: mdl-20214573
9.
Functional, biophysical, and structural bases for antibacterial activity of tigecycline.
Antimicrob Agents Chemother
; 50(6): 2156-66, 2006 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-16723578
10.
Synthesis and biological evaluation of biphenylsulfonamide carboxylate aggrecanase-1 inhibitors.
Bioorg Med Chem Lett
; 16(2): 311-6, 2006 Jan 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-16275085
11.
Discovery of novel inhibitors of the ZipA/FtsZ complex by NMR fragment screening coupled with structure-based design.
Bioorg Med Chem
; 14(23): 7953-61, 2006 Dec 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-16919463
12.
Structure-based identification of the binding site for the hemiasterlin analogue HTI-286 on tubulin.
Biochemistry
; 44(48): 15871-9, 2005 Dec 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-16313189
13.
Identification of potent and selective MMP-13 inhibitors.
Bioorg Med Chem Lett
; 15(18): 4105-9, 2005 Sep 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-16005220
14.
Potent, selective, and orally bioavailable matrix metalloproteinase-13 inhibitors for the treatment of osteoarthritis.
Bioorg Med Chem
; 13(24): 6629-44, 2005 Dec 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-16216515
15.
Synthesis and SAR of highly selective MMP-13 inhibitors.
Bioorg Med Chem Lett
; 15(22): 4961-6, 2005 Nov 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-16153831
16.
IR spectra of cytochrome c denatured with deuterated guanidine hydrochloride show increase in beta sheet.
Biopolymers
; 72(3): 193-204, 2003.
Artigo
em Inglês
| MEDLINE | ID: mdl-12722115
17.
The role of helix 1 aspartates and salt bridges in the stability and conversion of prion protein.
J Biol Chem
; 278(14): 12522-9, 2003 Apr 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-12551897
18.
Impact of mobility on structure-based drug design for the MMPs.
J Am Chem Soc
; 124(43): 12658-9, 2002 Oct 30.
Artigo
em Inglês
| MEDLINE | ID: mdl-12392402
19.
Structure-based design of carboxybiphenylindole inhibitors of the ZipA-FtsZ interaction.
Org Biomol Chem
; 1(23): 4138-40, 2003 Dec 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-14685315
20.
FeNO structure in distal pocket mutants of myoglobin based on resonance Raman spectroscopy.
Biochemistry
; 42(17): 4896-903, 2003 May 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-12718530