Concepedia

The multiobjective based design, synthesis and evaluation of the arylsulfonamide/amide derivatives of aryloxyethyl- and arylthioethyl- piperidines and pyrrolidines as a novel class of potent 5-HT7 receptor antagonists

Paweł Zajdel, Rafał Kurczab, Katarzyna Grychowska, Grzegorz Satała, Maciej Pawłowski, Andrzej J. Bojarski

European Journal of Medicinal Chemistry · 2012 · 41 citations · 34 references

Open access

Concepts

Combinatorial ChemistryMedicinal ChemistryDerivative (Chemistry)MedicinePharmacological AgentOrganic ChemistryArylsulfonamide/amide DerivativesPharmacotherapyNovel ClassPharmacologyArylthioethyl- PiperidinesDrug Discovery

References

34

Relationship between the inhibition constant (KI) and the concentration of inhibitor which causes 50 per cent inhibition (I50) of an enzymatic reaction

Yung-Chi Cheng, William H. Prusoff · Biochemical Pharmacology · 1973 · 12.8K citations

Cent Inhibition, Inhibitory Activity, Biochemistry +8

Advances in kernel methods: support vector learning

Bernhard Schölkopf, Christopher J. C. Burges, Alexander J. Smola · International Conference on Neural Information Processing · 1999 · 5.8K citations

Support Vector, Engineering, Machine Learning +16

Making Large-Scale SVM Learning Practical

Thorsten Joachims · Technical reports · 2006 · 4.3K citations · Full text

Artificial Intelligence, Mathematical Programming, Support Vector Machine +15

ChEMBL: a large-scale bioactivity database for drug discovery

Anna Gaulton, Louisa J. Bellis, A. Patrícia Bento et al. · Nucleic Acids Research · 2011 · 4.3K citations · Full text

Drug Target, Bioorganic Chemistry, Hit Identification +16

Benchmarking Sets for Molecular Docking

Niu Huang, Brian K. Shoichet, John J. Irwin · Journal of Medicinal Chemistry · 2006 · 1.3K citations · Full text