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Abbreviation : PASS
Long Form : Prediction of Activity Spectra for Substances
No. Year Title Co-occurring Abbreviation
2019 Steroidal glycoalkaloids from Solanum nigrum target cytoskeletal proteins: an in silico analysis. PCA, SAR, SGAs, SS
2018 Predictive antidiabetic activities of plants used by persons with Diabetes mellitus. DM
2017 Molecular docking, PASS analysis, bioactivity score prediction, synthesis, characterization and biological activity evaluationof a functionalized 2-butanone thiosemicarbazone ligand and its complexes. RR, topo II
2016 Antithrombotic and cytotoxic activities of four Bangladeshi plants and PASS prediction of their isolated compounds. ---
2016 Comparative Analysis of QSAR-based vs. Chemical Similarity Based Predictors of GPCRs Binding Affinity. GPCRs, k-NN, LBVS, QSAR, SEA
2016 Determining the mode of action of anti-mycobacterial C17 diyne natural products using expression profiling: evidence for fatty acid biosynthesis inhibition. ---
2016 Evaluation of structure-reactivity descriptors and biological activity spectra of 4-(6-methoxy-2-naphthyl)-2-butanone using spectroscopic techniques. DFT
2016 Rational Design and Synthesis of New, High Efficiency, Multipotent Schiff Base-1,2,4-triazole Antioxidants Bearing Butylated Hydroxytoluene Moieties. BHT, MPAOs, SAR
2016 Synthesis, antibacterial studies, and molecular modeling studies of 3,4-dihydropyrimidinone compounds. DHPMs
10  2016 Synthesis, PASS-Predication and in Vitro Antimicrobial Activity of Benzyl 4-O-benzoyl-alpha-l-rhamnopyranoside Derivatives. SAR
11  2016 [The effect of 3,5-dicarbomethoxyphenylbiguanide on the activity of antioxidant enzymes]. ---
12  2015 Spectroscopic methods and theoretical studies of bromoacetyl substituted derivatives of bile acids. ---
13  2015 Structural investigation of ginsenoside Rf with PPARgamma major transcriptional factor of adipogenesis and its impact on adipocyte. ADMET
14  2014 PASS-assisted design, synthesis and antioxidant evaluation of new butylated hydroxytoluene derivatives. BHT, MPAOs, SAR
15  2014 PASS-predicted hepatoprotective activity of Caesalpinia sappan in thioacetamide-induced liver fibrosis in rats. alpha-SMA, CS, CYP2E1, PCNA, SY, TAA, TGF-beta1
16  2014 Revealing pharmacodynamics of medicinal plants using in silico approach: a case study with wet lab validation. GABA-AT, PTZ
17  2014 Synthesis, spectroscopic and theoretical studies of new dimeric quaternary alkylammonium conjugates of sterols. ---
18  2014 Synthesis, spectroscopic and theoretical studies of new quasi-podands from bile acid derivatives linked by 1,2,3-triazole rings. ---
19  2014 Synthesis, spectroscopic and theoretical studies of new quaternary N,N-dimethyl-3-phthalimidopropylammonium conjugates of sterols and bile acids. ---
20  2013 DIGEP-Pred: web service for in silico prediction of drug-induced gene expression profiles based on structural formula. ---
21  2013 PASS-predicted Vitex negundo activity: antioxidant and antiproliferative properties on human hepatoma cells--an in vitro study. BHT, DPPH, FRAP, GPx, LDH, MTT, SOD, VN
22  2013 Synthesis, spectroscopic and semiempirical studies of new quaternary alkylammonium conjugates of sterols. ---
23  2012 Butylated hydroxytoluene analogs: synthesis and evaluation of their multipotent antioxidant activities. BHT, DPPH, MPAOs, PSA
24  2012 Design, synthesis, computational and biological evaluation of some new hydrazino derivatives of DHA and pyranopyrazoles. ---
25  2012 Reactions of N(3) -substituted amidrazones with cis-1,2-cyclohexanedicarboxylic anhydride and biological activities of the products. ---
26  2011 Thio Analogs of Pyrimidine Bases: Synthesis, Spectroscopic Study, and In Silico Biological Activity Evaluation of New 2-o-(m- and p-)Chlorobenzylthio-6-Methyl-5-Piperidino-(Morpholino-)Methyluracils. ---
27  2009 Inhibition of Toxoplasma gondii and Plasmodium falciparum infections in vitro by NSC3852, a redox active antiproliferative and tumor cell differentiation agent. NCI, NO, ROS
28  2008 Synthesis and in silico biological activity evaluation of new N-substituted pyrazolo-oxazin-2-one systems. ---
29  2006 Toward automated biochemotype annotation for large compound libraries. CACL, MDDR, MEP
30  2005 PASS assisted search and evaluation of some azetidin-2-ones as C.N.S. active agents. CNS, EPM
31  2002 Computer aided prediction of biological activity spectra: evaluating versus known and predicting of new activities for thiazole derivatives. Pa
32  2001 Discriminating between drugs and nondrugs by prediction of activity spectra for substances (PASS). ---