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  • Search Condition : Filter (MeSH = Molecular Docking Simulation)
Species Resource Title
Algae NIES-2134 Structural implications for a phycobilisome complex from the thermophilic cyanobacterium Thermosynechococcus vulcanus.
Human and Animal Cells U251(RCB0461) EGFR-Targeted Pentacyclic Triterpene Analogues for Glioma Therapy.
Human and Animal Cells HeLa S3 , A549 , PC-3 Synthetic prodrug design enables biocatalytic activation in mice to elicit tumor growth suppression.
Human and Animal Cells 293T(RCB2202) Synthesis of C12-Keto Saxitoxin Derivatives with Unusual Inhibitory Activity Against Voltage-Gated Sodium Channels.
General Microbes JCM21189 , JCM3725 , JCM32818 Rosmarinic Acid and Sodium Citrate Have a Synergistic Bacteriostatic Effect against Vibrio Species by Inhibiting Iron Uptake.
Human and Animal Cells Atg5^(+/+)MEF(RCB2710) , Atg5^(-/-)MEF(RCB2711) Japanese encephalitis virus capsid protein interacts with non-lipidated MAP1LC3 on replication membranes and lipid droplets.
Human and Animal Cells HCT116(RCB2979) In Vitro and In Silico Study of Analogs of Plant Product Plastoquinone to Be Effective in Colorectal Cancer Treatment.
Human and Animal Cells HL60(RCB0041) Mitocryptide-2: Identification of Its Minimum Structure for Specific Activation of FPR2-Possible Receptor Switching from FPR2 to FPR1 by Its Physiological C-terminal Cleavages.
Human and Animal Cells HeLa(RCB0007) 2-Carba-lysophosphatidic acid is a novel β-lysophosphatidic acid analogue with high potential for lysophosphatidic acid receptor activation and autotaxin inhibition.
Human and Animal Cells Hep G2(RCB1886) Identification of a New Type of Covalent PPARγ Agonist using a Ligand-Linking Strategy.
Human and Animal Cells A549(RCB0098) Design, synthesis, and evaluation of a novel prodrug, a S-trityl-l-cysteine derivative targeting kinesin spindle protein.
Human and Animal Cells CW-2(RCB0778) Co-occurring gain-of-function mutations in HER2 and HER3 modulate HER2/HER3 activation, oncogenesis, and HER2 inhibitor sensitivity.
Human and Animal Cells MH7A(RCB1512) Kaempferol targeting on the fibroblast growth factor receptor 3-ribosomal S6 kinase 2 signaling axis prevents the development of rheumatoid arthritis.
Prokaryotes E. coli ASKA collection , JW0599 Novel 5-Nitrofuran-Activating Reductase in Escherichia coli.
Human and Animal Cells HeLa Haemorrhagic snake venom metalloproteases and human ADAMs cleave LRP5/6, which disrupts cell-cell adhesions in vitro and induces haemorrhage in vivo.
Human and Animal Cells PC-9(RCB4455) Discovery of N-((3R,4R)-4-Fluoro-1-(6-((3-methoxy-1-methyl-1H-pyrazol-4-yl)amino)-9-methyl-9H-purin-2-yl)pyrrolidine-3-yl)acrylamide (PF-06747775) through Structure-Based Drug Design: A High Affinity Irreversible Inhibitor Targeting Oncogenic EGFR Mutants with Selectivity over Wild-Type EGFR.
Human and Animal Cells HCE-T(RCB2280) Biological Evaluation of Azomethine-dihydroquinazolinone Conjugates as Cancer and Cholinesterase Inhibitors.
Arabidopsis / Cultured plant cells, genes pda03105 Deciphering the Binding of Salicylic Acid to Arabidopsis thaliana Chloroplastic GAPDH-A1.
Human and Animal Cells MKN1(RCB1003) (S)-Erypoegin K, an isoflavone isolated from Erythrina poeppigiana, is a novel inhibitor of topoisomerase IIα: Induction of G2 phase arrest in human gastric cancer cells.
Human and Animal Cells CHO-K1(RCB0285) Differential Regulation of Bilastine Affinity for Human Histamine H1 Receptors by Lys 179 and Lys 191 via Its Binding Enthalpy and Entropy.