Evaluating kratom alkaloids using PHASE

Assessing the Structural and Pharmacological Similarity of Newly Identified Drugs of Abuse to Controlled Substances Using Public Health Assessment via Structural Evaluation

(2019) Christopher R. Ellis et al.   CLINICAL PHARMACOLOGY & THERAPEUTICS

The medicinal chemistry and neuropharmacology of kratom: A preliminary discussion of a promising medicinal plant and analysis of its potential for abuse

(2018) Andrew C. Kruegel et al.   NEUROPHARMACOLOGY

Predicting opioid receptor binding affinity of pharmacologically unclassified designer substances using molecular docking

(2018) Christopher R. Ellis et al.   PLoS One

Binding Affinity via Docking: Fact and Fiction

(2018) Tatu Pantsar et al.   MOLECULES

Abuse liability of mitragynine assessed with a self-administration procedure in rats

(2018) Kai Yue et al.   PSYCHOPHARMACOLOGY

Serotonin and brain function: a tale of two receptors

(2017) RL Carhart-Harris et al.   JOURNAL OF PSYCHOPHARMACOLOGY

Mitragynine/Corynantheidine Pseudoindoxyls As Opioid Analgesics with Mu Agonism and Delta Antagonism, Which Do Not Recruit β-Arrestin-2

(2016) András Váradi et al.   JOURNAL OF MEDICINAL CHEMISTRY

Synthetic and Receptor Signaling Explorations of the Mitragyna Alkaloids: Mitragynine as an Atypical Molecular Framework for Opioid Receptor Modulators

(2016) Andrew C. Kruegel et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Mitragynine and its potential blocking effects on specific cardiac potassium channels

(2016) Yea Lu Tay et al.   TOXICOLOGY AND APPLIED PHARMACOLOGY

Notes from the Field: Kratom (Mitragyna speciosa) Exposures Reported to Poison Centers — United States, 2010–2015

(2016) Mehruba Anwar et al.   MMWR-MORBIDITY AND MORTALITY WEEKLY REPORT

Large-Scale Predictive Drug Safety: From Structural Alerts to Biological Mechanisms

(2015) Ricard Garcia-Serna et al.   CHEMICAL RESEARCH IN TOXICOLOGY

Serotonergic System and Its Role in Epilepsy and Neuropathic Pain Treatment: A Review Based on Receptor Ligands

(2015) Katarzyna Panczyk et al.   CURRENT PHARMACEUTICAL DESIGN

Structural insights into µ-opioid receptor activation

(2015) Weijiao Huang et al.   NATURE

PubChem Substance and Compound databases

(2015) Sunghwan Kim et al.   NUCLEIC ACIDS RESEARCH

Following “the Roots” of Kratom (Mitragyna speciosa): The Evolution of an Enhancer from a Traditional Use to Increase Work and Productivity in Southeast Asia to a Recreational Psychoactive Drug in Western Countries

(2015) Eduardo Cinosi et al.   Biomed Research International

Abuse potential and adverse cognitive effects of mitragynine (kratom)

(2014) Nurul H. M. Yusoff et al.   ADDICTION BIOLOGY

Kratom (Mitragyna speciosa) dependence, withdrawal symptoms and craving in regular users

(2014) Darshan Singh et al.   DRUG AND ALCOHOL DEPENDENCE

Mutation of Three Residues in the Third Intracellular Loop of the Dopamine D2Receptor Creates an Internalization-defective Receptor

(2014) Cecilea C. Clayton et al.   JOURNAL OF BIOLOGICAL CHEMISTRY

Variability in docking success rates due to dataset preparation

(2012) Christopher R. Corbeil et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

Crystal structure of the µ-opioid receptor bound to a morphinan antagonist

(2012) Aashish Manglik et al.   NATURE

Automated design of ligands to polypharmacological profiles

(2012) Jérémy Besnard et al.   NATURE

From Kratom to mitragynine and its derivatives: Physiological and behavioural effects related to use, abuse, and addiction

(2012) Zurina Hassan et al.   NEUROSCIENCE AND BIOBEHAVIORAL REVIEWS

Mitragyna speciosa, A Psychoactive Tree from Southeast Asia with Opioid Activity

(2011) Jessica E. Adkins et al.   CURRENT TOPICS IN MEDICINAL CHEMISTRY

In Silico Receptorome Screening of Antipsychotic Drugs

(2010) David Vidal et al.   Molecular Informatics

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

(2009) Garrett M. Morris et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Predicting new molecular targets for known drugs

(2009) Michael J. Keiser et al.   NATURE

Self-treatment of opioid withdrawal using kratom (Mitragynia speciosa korth)

(2008) Edward W. Boyer et al.   ADDICTION