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                             41 gevonden resultaten
nr titel auteur tijdschrift jaar jaarg. afl. pagina('s) type
1 Arylazolyl(azinyl)thioacetanilides. Part 10: Design, synthesis and biological evaluation of novel substituted imidazopyridinylthioacetanilides as potent HIV-1 inhibitors Li, Xiao
2012
20 18 p. 5527-5536
10 p.
artikel
2 Backtranslating clinical knowledge for use in cheminformatics—What is the potential? Scheiber, Josef
2012
20 18 p. 5461-5463
3 p.
artikel
3 Bioactivity landscape modeling: Chemoinformatic characterization of structure–activity relationships of compounds tested across multiple targets Waddell, Jacob
2012
20 18 p. 5443-5452
10 p.
artikel
4 Bioorganic & Medicinal Chemistry Reviews and Perspectives 2012
20 18 p. I-III
nvt p.
artikel
5 BioProfile—Extract knowledge from corporate databases to assess cross-reactivities of compounds Beck, Bernd
2012
20 18 p. 5428-5435
8 p.
artikel
6 C-Glucosylated malonitrile as a key intermediate towards carbohydrate-based glycogen phosphorylase inhibitors Feuillastre, Sophie
2012
20 18 p. 5592-5599
8 p.
artikel
7 Chemoinformatics: A view of the field and current trends in method development Vogt, Martin
2012
20 18 p. 5317-5323
7 p.
artikel
8 Chemoinformatics: Recent advances at the interfaces between computer and chemical information sciences, chemistry, and drug discovery Bajorath, Jürgen
2012
20 18 p. 5316-
1 p.
artikel
9 Chemotography for multi-target SAR analysis in the context of biological pathways Lounkine, Eugen
2012
20 18 p. 5416-5427
12 p.
artikel
10 Cluster analysis of the DrugBank chemical space using molecular quantum numbers Awale, Mahendra
2012
20 18 p. 5372-5378
7 p.
artikel
11 Combining multiple classifications of chemical structures using consensus clustering Chu, Chia-Wei
2012
20 18 p. 5366-5371
6 p.
artikel
12 Conjugation of cyclodextrin with fullerene as a new class of HCV entry inhibitors Xiao, Su-long
2012
20 18 p. 5616-5622
7 p.
artikel
13 Database of bioactive ring systems with calculated properties and its use in bioisosteric design and scaffold hopping Ertl, Peter
2012
20 18 p. 5436-5442
7 p.
artikel
14 Design and synthesis of novel DFG-out RAF/vascular endothelial growth factor receptor 2 (VEGFR2) inhibitors: 3. Evaluation of 5-amino-linked thiazolo[5,4-d]pyrimidine and thiazolo[5,4-b]pyridine derivatives Hirose, Masaaki
2012
20 18 p. 5600-5615
16 p.
artikel
15 Design of potent bisphosphonate inhibitors of the human farnesyl pyrophosphate synthase via targeted interactions with the active site ‘capping’ phenyls De Schutter, Joris W.
2012
20 18 p. 5583-5591
9 p.
artikel
16 Design, synthesis and structure–activity relationships of novel benzoxazolone derivatives as 18kDa translocator protein (TSPO) ligands Fukaya, Takayuki
2012
20 18 p. 5568-5582
15 p.
artikel
17 Development of in silico filters to predict activation of the pregnane X receptor (PXR) by structurally diverse drug-like molecules Matter, Hans
2012
20 18 p. 5352-5365
14 p.
artikel
18 Discovery of pyrrolo[3,2-c]quinoline-4-one derivatives as novel hedgehog signaling inhibitors Ohashi, Tomohiro
2012
20 18 p. 5496-5506
11 p.
artikel
19 Discovery of structurally-diverse inhibitor scaffolds by high-throughput screening of a fragment library with dimethylarginine dimethylaminohydrolase Linsky, Thomas W.
2012
20 18 p. 5550-5558
9 p.
artikel
20 Discovery of the investigational drug TAK-441, a pyrrolo[3,2-c]pyridine derivative, as a highly potent and orally active hedgehog signaling inhibitor: Modification of the core skeleton for improved solubility Ohashi, Tomohiro
2012
20 18 p. 5507-5517
11 p.
artikel
21 Early phase drug discovery: Cheminformatics and computational techniques in identifying lead series Duffy, Bryan C.
2012
20 18 p. 5324-5342
19 p.
artikel
22 Editorial board 2012
20 18 p. IFC-
1 p.
artikel
23 Fingerprint-based in silico models for the prediction of P-glycoprotein substrates and inhibitors Poongavanam, Vasanthanathan
2012
20 18 p. 5388-5395
8 p.
artikel
24 Graphical contents list 2012
20 18 p. 5305-5315
11 p.
artikel
25 Hole filling and library optimization: Application to commercially available fragment libraries An, Yuling
2012
20 18 p. 5379-5387
9 p.
artikel
26 Identification and synthesis of substituted pyrrolo[2,3-d]pyrimidines as novel firefly luciferase inhibitors Liu, Yang
2012
20 18 p. 5473-5482
10 p.
artikel
27 New artesunic acid homodimers: Potent reversal agents of multidrug resistance in leukemia cells Reiter, Christoph
2012
20 18 p. 5637-5641
5 p.
artikel
28 New description of protein–ligand interactions using a spherical self-organizing map Hasegawa, Kiyoshi
2012
20 18 p. 5410-5415
6 p.
artikel
29 RETRACTED: Corrigendum to “3-Benzhydryl-4-piperidones as novel neurokinin-1 receptor antagonists and their efficient synthesis” [Bioorg. Med. Chem. 19 (2011) 5175–5182] Shirai, Junya
2012
20 18 p. 5668-
1 p.
artikel
30 Riluzole prodrugs for melanoma and ALS: Design, synthesis, and in vitro metabolic profiling McDonnell, Mark E.
2012
20 18 p. 5642-5648
7 p.
artikel
31 Softening the Rule of Five—where to draw the line? Petit, Joachim
2012
20 18 p. 5343-5351
9 p.
artikel
32 Structure-anti-leukemic activity relationship study of ortho-dihydroxycoumarins in U-937 cells: Key role of the δ-lactone ring in determining differentiation-inducing potency and selective pro-apoptotic action Vázquez, Ramiro
2012
20 18 p. 5537-5549
13 p.
artikel
33 Synthesis and antimalarial activity of new haemanthamine-type derivatives Cedrón, Juan C.
2012
20 18 p. 5464-5472
9 p.
artikel
34 Synthesis and pharmacological evaluation of indolinone derivatives as novel ghrelin receptor antagonists Puleo, Letizia
2012
20 18 p. 5623-5636
14 p.
artikel
35 Synthesis and SAR studies of 3-allyl-4-prenyloxyaniline amides as potent 15-lipoxygenase inhibitors Jabbari, Atena
2012
20 18 p. 5518-5526
9 p.
artikel
36 Synthesis, biological evaluation, and molecular docking of N-{3-[3-(9-methyl-9H-carbazol-3-yl)-acryloyl]-phenyl}-benzamide/amide derivatives as xanthine oxidase and tyrosinase inhibitors Bandgar, Babasaheb P.
2012
20 18 p. 5649-5657
9 p.
artikel
37 Synthesis of Paclitaxel–BGL Conjugates Nemoto, Hisao
2012
20 18 p. 5559-5567
9 p.
artikel
38 Synthesis of stable isotope labelled internal standards for drug–drug interaction (DDI) studies Atzrodt, J.
2012
20 18 p. 5658-5667
10 p.
artikel
39 UDP made a highly promising stable, potent, and selective P2Y6-receptor agonist upon introduction of a boranophosphate moiety Ginsburg-Shmuel, Tamar
2012
20 18 p. 5483-5495
13 p.
artikel
40 Using self-organizing maps to accelerate similarity search Bonachera, Fanny
2012
20 18 p. 5396-5409
14 p.
artikel
41 Who cares for the protons? Czodrowski, Paul
2012
20 18 p. 5453-5460
8 p.
artikel
                             41 gevonden resultaten
 
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