Concepedia

Pharmacophore Model Optimization

Pharmacophore Model Optimization is a computational methodology that iteratively refines the spatial and physicochemical features of a pharmacophore model to enhance its accuracy, selectivity, and predictive power in identifying bioactive compounds.

327

Publications

12.4K

Citations

2K

Authors

548

Institutions

Publications per year

2017–2026

104

Parents

Publications

327

A genetic algorithm for flexible molecular overlay and pharmacophore elucidation

Gareth Jones, Peter Willett, Robert C. Glen · Journal of Computer-Aided Molecular Design · 1995 · 392 citations

, , +16

Three-Dimensional Quantitative Structure-Activity Relationship for Inhibition of Human Ether-a-Go-Go-Related Gene Potassium Channel

Sean Ekins, William Crumb, R. Dustan Sarazan et al. · Journal of Pharmacology and Experimental Therapeutics · 2002 · 261 citations

, , +17

Use of a Pharmacophore Model for the Design of EGF-R Tyrosine Kinase Inhibitors:  4-(Phenylamino)pyrazolo[3,4-<i>d</i>]pyrimidines

Peter Traxler, Guido Bold, Joerg Frei et al. · Journal of Medicinal Chemistry · 1997 · 205 citations · Full text

, , +17

The discovery of potential acetylcholinesterase inhibitors: A combination of pharmacophore modeling, virtual screening, and molecular docking studies

Shin-Hua Lu, Josephine W. Wu, Hsuan‐Liang Liu et al. · Journal of Biomedical Science · 2011 · 196 citations · Full text

, , +17

Discovery of Tofogliflozin, a Novel <i>C</i>-Arylglucoside with an <i>O</i>-Spiroketal Ring System, as a Highly Selective Sodium Glucose Cotransporter 2 (SGLT2) Inhibitor for the Treatment of Type 2 Diabetes

Yoshihito Ohtake, Tsutomu Sato, Takamitsu Kobayashi et al. · Journal of Medicinal Chemistry · 2012 · 168 citations · Full text

, , +17

1–5 of 327

Authors

2K

  1. KW
    Keun Woo Lee

    Gyeongsang National University, South Korea

    8 publications · 266 citations

    8

    h-index

  2. TL
    Tommy Liljefors

    Lund University, Sweden

    5 publications · 247 citations

    5

    h-index

  3. ZU
    Zaheer Ul‐Haq

    University of Karachi, Pakistan

    5 publications · 87 citations

    5

    h-index

  4. HJ
    Hualiang Jiang

    Shanghai Institute of Materia Medica, China

    4 publications · 121 citations

    4

    h-index

  5. FM
    Fabrizio Manetti

    University of Siena, Italy

    4 publications · 238 citations

    4

    h-index

1–5 of 2K

Institutions

548

  1. Gyeongsang National University

    Jinju-si, South Korea

    8 h-index

    46 publications

    1.7K citations

  2. Shanghai Institute of Materia Medica

    Pudong, China

    7 h-index

    38 publications

    1.1K citations

  3. Central Drug Research Institute

    Lucknow, India

    7 h-index

    23 publications

    451 citations

  4. University of Perugia

    Perugia, Italy

    6 h-index

    20 publications

    1.6K citations

  5. China Pharmaceutical University

    Nanjing, China

    6 h-index

    27 publications

    494 citations

  6. Chinese Academy of Sciences

    Beijing, China

    6 h-index

    31 publications

    940 citations

  7. University of Karachi

    Karachi, Pakistan

    5 h-index

    12 publications

    207 citations

  8. Universität Innsbruck

    Innsbruck, Austria

    5 h-index

    20 publications

    567 citations

1–8 of 548

Venues

  1. Journal of Medicinal Chemistry

    56 publications · 3.8K citations

    36

    h-index

  2. Journal of Biomolecular Structure and Dynamics

    20 publications · 580 citations

    15

    h-index

  3. Journal of Chemical Information and Modeling

    JCIM · 15 publications · 615 citations

    14

    h-index

  4. Chemical Biology & Drug Design

    12 publications · 255 citations

    11

    h-index

  5. Bioorganic & Medicinal Chemistry Letters

    10 publications · 280 citations

    10

    h-index

1–5