Detalhe da pesquisa
1.
MELLODDY: Cross-pharma Federated Learning at Unprecedented Scale Unlocks Benefits in QSAR without Compromising Proprietary Information.
J Chem Inf Model
; 64(7): 2331-2344, 2024 Apr 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-37642660
2.
Deep generative models for ligand-based de novo design applied to multi-parametric optimization.
J Comput Chem
; 43(10): 692-703, 2022 04 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35218219
3.
Shape-Based Descriptors for Efficient Structure-Based Fragment Growing.
J Chem Inf Model
; 60(12): 6269-6281, 2020 12 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-33196169
4.
Design and synthesis of novel N-sulfonyl-2-indoles that behave as 5-HT6 receptor ligands with significant selectivity for D3 over D2 receptors.
Bioorg Med Chem
; 25(1): 38-52, 2017 01 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-28029458
5.
Synthesis and pharmacological evaluation of thieno[2,3-b]pyridine derivatives as novel c-Src inhibitors.
Bioorg Med Chem
; 19(8): 2517-28, 2011 Apr 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-21459579
6.
Development of a chemogenomics library for phenotypic screening.
J Cheminform
; 13(1): 91, 2021 Nov 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-34819133
7.
Studies of the melatonin binding site location onto quinone reductase 2 by directed mutagenesis.
Arch Biochem Biophys
; 477(1): 12-9, 2008 Sep 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-18502195
8.
Importance of the second extracellular loop for melatonin MT1 receptor function and absence of melatonin binding in GPR50.
Br J Pharmacol
; 175(16): 3281-3297, 2018 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-28898928
9.
Novel structural insights for drug design of selective 5-HT(2C) inverse agonists from a ligand-biased receptor model.
Eur J Med Chem
; 45(11): 5086-99, 2010 Nov.
Artigo
em Inglês
| MEDLINE | ID: mdl-20880612
10.
Pyridyldithiafulvenes as precursors of coordination-driven self-assembled redox active macrocycle.
Org Lett
; 12(10): 2386-9, 2010 May 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-20402484