Role of breast cancer resistance protein (BCRP) as active efflux transporter on blood-brain barrier (BBB) permeability

Predicting substrates of the human breast cancer resistance protein using a support vector machine method

(2013) Eszter Hazai et al.   BMC BIOINFORMATICS

QSAR Study of Curcumine Derivatives as HIV-1 Integrase Inhibitors

(2013) Pawan Gupta et al.   Current Computer-Aided Drug Design

A fragment-based approach for the in silico prediction of blood-brain barrier permeation

(2013) Tiago L. Moda et al.   JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY

Computational Prediction of CNS Drug Exposure Based on a Novel In Vivo Dataset

(2012) Christel A. S. Bergström et al.   PHARMACEUTICAL RESEARCH

In-silico prediction of blood–brain barrier permeability

(2012) A. Yan et al.   SAR AND QSAR IN ENVIRONMENTAL RESEARCH

A prediction model of substrates and non-substrates of breast cancer resistance protein (BCRP) developed by GA–CG–SVM method

(2011) Lei Zhong et al.   COMPUTERS IN BIOLOGY AND MEDICINE

Qualitative prediction of blood–brain barrier permeability on a large and refined dataset

(2011) Markus Muehlbacher et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Insights for Predicting Blood-Brain Barrier Penetration of CNS Targeted Molecules Using QSPR Approaches

(2010) Yi Fan et al.   Journal of Chemical Information and Modeling

Role of Basic Residues within or near the Predicted Transmembrane Helix 2 of the Human Breast Cancer Resistance Protein in Drug Transport

(2010) X. Cai et al.   JOURNAL OF PHARMACOLOGY AND EXPERIMENTAL THERAPEUTICS

A prediction model for blood–brain barrier permeation and analysis on its parameter biologically

(2009) Yan Chen et al.   COMPUTER METHODS AND PROGRAMS IN BIOMEDICINE

Brain drug targeting: a computational approach for overcoming blood–brain barrier

(2009) Ahmad Reza Mehdipour et al.   DRUG DISCOVERY TODAY

Automatic QSAR modeling of ADME properties: blood–brain barrier penetration and aqueous solubility

(2008) Olga Obrezanova et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Generation of a Set of Simple, Interpretable ADMET Rules of Thumb

(2008) M. Paul Gleeson   JOURNAL OF MEDICINAL CHEMISTRY

Ionization-Specific Prediction of Blood–Brain Permeability

(2008) Kiril Lanevskij et al.   JOURNAL OF PHARMACEUTICAL SCIENCES

Homology modeling of breast cancer resistance protein (ABCG2)

(2008) Eszter Hazai et al.   JOURNAL OF STRUCTURAL BIOLOGY

New Predictive Models for Blood–Brain Barrier Permeability of Drug-like Molecules

(2008) Sandhya Kortagere et al.   PHARMACEUTICAL RESEARCH

QSAR Modeling of the Blood–Brain Barrier Permeability for Diverse Organic Compounds

(2008) Liying Zhang et al.   PHARMACEUTICAL RESEARCH

In SilicoPrediction of Blood–Brain Partitioning Using a Chemometric Method Called Genetic Algorithm Based Variable Selection

(2008) Jie Shen et al.   Quantitative structure-activity relationships & combinatorial science