On the public citation graph

Metabolic Activation of a Novel 3-Substituted Indole-Containing TNF-α Inhibitor: Dehydrogenation and Inactivation of CYP3A4

0 signed · 81 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.

Claim with ORCID

Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.

See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/(sici)1099-1352(199601)9:1<1::aid-jmr241>3.0.co;2-6openalex-snapshot

Automated docking of flexible ligands: Applications of autodock

inferredcites →https://doi.org/10.1002/bms.1200220602openalex-snapshot

Mass spectrometry in the analysis of glutathione conjugates

inferredcites →https://doi.org/10.1016/j.bmcl.2007.03.058openalex-snapshot

Metabolic activation of indole-containing prostaglandin D2 receptor 1 antagonists: Impacts of glutathione trapping and glucuronide conjugation on covalent binding

inferredcites →https://doi.org/10.1016/s0003-9861(02)00415-0openalex-snapshot

Cytochrome P450 oxidations in the generation of reactive electrophiles: epoxidation and related reactions

inferredcites →https://doi.org/10.1016/s0090-9556(24)15228-2openalex-snapshot

Specific Dehydrogenation of 3-Methylindole and Epoxidation of Naphthalene by Recombinant Human CYP2F1 Expressed in Lymphoblastoid Cells

inferredcites →https://doi.org/10.1021/bi992412uopenalex-snapshot

Mechanism-Based Inactivation of Cytochrome P450 3A4 by L-754,394

inferredcites →https://doi.org/10.1021/tx00011a001openalex-snapshot

Mechanisms of 3-methylindole pneumotoxicity

inferredcites →https://doi.org/10.1021/tx0100237openalex-snapshot

Detection and Characterization of DNA Adducts of 3-Methylindole

inferredcites →https://doi.org/10.1021/tx034143lopenalex-snapshot

Mechanism-Based Inactivation of Cytochrome P450 3A4 by 4-Ipomeanol

inferredcites →https://doi.org/10.1021/tx050092bopenalex-snapshot

Zafirlukast Metabolism by Cytochrome P450 3A4 Produces an Electrophilic α,β-Unsaturated Iminium Species That Results in the Selective Mechanism-Based Inactivation of the Enzyme

inferredcites →https://doi.org/10.1021/tx060239eopenalex-snapshot

Metabolism and Bioactivation of 3-Methylindole by Human Liver Microsomes

inferredcites →https://doi.org/10.1021/tx9501187openalex-snapshot

Mechanistic Studies on the Cytochrome P450-Catalyzed Dehydrogenation of 3-Methylindole

inferredcites →https://doi.org/10.1021/tx970192kopenalex-snapshot

Inactivation of Cytochrome P450 3A4 by Bergamottin, a Component of Grapefruit Juice

inferredcites →https://doi.org/10.1038/nrd1549openalex-snapshot

Docking and scoring in virtual screening for drug discovery: methods and applications

inferredcites →https://doi.org/10.1038/nri802openalex-snapshot

Development of anti-TNF therapy for rheumatoid arthritis

inferredcites →https://doi.org/10.1038/nsmb971openalex-snapshot

Structures of human microsomal cytochrome P450 2A6 complexed with coumarin and methoxsalen

inferredcites →https://doi.org/10.1074/jbc.c400293200openalex-snapshot

The Structure of Human Microsomal Cytochrome P450 3A4 Determined by X-ray Crystallography to 2.05-Å Resolution

inferredcites →https://doi.org/10.1074/jbc.m312516200openalex-snapshot

Structure of Human Microsomal Cytochrome P450 2C8

inferredcites →https://doi.org/10.1074/jbc.m405427200openalex-snapshot

The Structure of Human Cytochrome P450 2C9 Complexed with Flurbiprofen at 2.0-Å Resolution

inferredcites →https://doi.org/10.1074/jbc.m511232200openalex-snapshot

Crystal Structure of Human Cytochrome P450 2D6

inferredcites →https://doi.org/10.1074/jbc.m611692200openalex-snapshot

Adaptations for the Oxidation of Polycyclic Aromatic Hydrocarbons Exhibited by the Structure of Human P450 1A2

inferredcites →https://doi.org/10.1080/00498250210158230openalex-snapshot

Reversible and irreversible inhibition of CYP3A enzymes by tamoxifen and metabolites

inferredcites →https://doi.org/10.1124/dmd.104.001214openalex-snapshot

STRUCTURAL AND ENZYMATIC PARAMETERS THAT DETERMINE ALKYL DEHYDROGENATION/HYDROXYLATION OF CAPSAICINOIDS BY CYTOCHROME P450 ENZYMES

inferredcites →https://doi.org/10.1124/dmd.106.011551openalex-snapshot

Metabolism of MK-0524, a Prostaglandin D2 Receptor 1 Antagonist, in Microsomes and Hepatocytes from Preclinical Species and Humans

inferredcites →https://doi.org/10.1124/jpet.107.121723openalex-snapshot

Dehydrogenation of Indoline by Cytochrome P450 Enzymes: A Novel “Aromatase” Process

inferredcites →https://doi.org/10.1124/jpet.301.1.160openalex-snapshot

Mechanism-Based Inactivation of Cytochrome P450 3A4 by 17α-Ethynylestradiol: Evidence for Heme Destruction and Covalent Binding to Protein

inferredcites →https://doi.org/10.1126/science.1116304openalex-snapshot

Small-Molecule Inhibition of TNF-α

inferredcites →https://doi.org/10.1186/ar996openalex-snapshot

Does route of administration affect the outcome of TNF antagonist therapy?

inferredcites →https://doi.org/10.1208/aapsj080112openalex-snapshot

Cytochrome P450s and other enzymes in drug metabolism and toxicity

inferredcites →https://doi.org/10.3109/00498258409151448openalex-snapshot

Electrophilic metabolites of 3-methylindole as toxic intermediates in pulmonary oedema

inferredcites →https://doi.org/10.7326/0003-4819-135-10-200111200-00023openalex-snapshot

Severe Liver Injury Associated with Zafirlukast

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.3897/pharmacia.72.e158823zenodo-depositor-declared

In silico metabolism and toxicity prediction using a knowledge-based approach

inferred← citeshttps://doi.org/10.1002/9780470921920.edm072openalex-snapshot

Bioactivation I: Bioactivation by Cytochrome P450s

inferred← citeshttps://doi.org/10.1002/9781118681121.ch24openalex-snapshot

Using Crystal Structures of Drug‐Metabolizing Enzymes in Mechanism‐Based Modeling for Drug Design

inferred← citeshttps://doi.org/10.1002/9783527655748.ch9openalex-snapshot

Bioactivation and Natural Products

inferred← citeshttps://doi.org/10.1002/ange.200907360openalex-snapshot

Structure‐Based Discovery of Natural‐Product‐like TNF‐α Inhibitors

inferred← citeshttps://doi.org/10.1002/anie.200907360openalex-snapshot

Structure‐Based Discovery of Natural‐Product‐like TNF‐α Inhibitors

inferred← citeshttps://doi.org/10.1002/ardp.201400198openalex-snapshot

Rationally Designed Less Toxic SPD‐304 Analogs and Preliminary Evaluation of Their TNF Inhibitory Effects

inferred← citeshttps://doi.org/10.1002/ddr.20223openalex-snapshot

Drug design: hiding in full view

inferred← citeshttps://doi.org/10.1016/bs.apcsb.2019.12.006openalex-snapshot

Protein-protein interactions: a structural view of inhibition strategies and the IL-23/IL-17 axis

inferred← citeshttps://doi.org/10.1016/j.bbagen.2012.05.011openalex-snapshot

Conformational dynamics of CYP3A4 demonstrate the important role of Arg212 coupled with the opening of ingress, egress and solvent channels to dehydrogenation of 4-hydroxy-tamoxifen

inferred← citeshttps://doi.org/10.1016/j.bmcl.2009.04.118openalex-snapshot

Differences in CYP3A4 catalyzed bioactivation of 5-aminooxindole and 5-aminobenzsultam scaffolds in proline-rich tyrosine kinase 2 (PYK2) inhibitors: Retrospective analysis by CYP3A4 molecular docking, quantum chemical calculations and glutathione adduct detection using linear ion trap/orbitrap…

inferred← citeshttps://doi.org/10.1016/j.bmcl.2011.10.121openalex-snapshot

Dirlotapide as a model substrate to refine structure-based drug design strategies on CYP3A4-catalyzed metabolism

inferred← citeshttps://doi.org/10.1016/j.bmcl.2015.03.025openalex-snapshot

2′-Hydroxy flavanone derivatives as an inhibitors of pro-inflammatory mediators: Experimental and molecular docking studies

inferred← citeshttps://doi.org/10.1016/j.cbi.2011.08.011openalex-snapshot

Impact of genetic polymorphisms of cytochrome P450 2 C (CYP2C) enzymes on the drug metabolism and design of antidiabetics

inferred← citeshttps://doi.org/10.1016/j.cbi.2012.03.001openalex-snapshot

In vitro bioactivation of bazedoxifene and 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol in human liver microsomes

inferred← citeshttps://doi.org/10.1016/j.ejmech.2026.118780openalex-snapshot

Unlocking the potential of TNF: From biologic agents to small-molecule inhibitors

inferred← citeshttps://doi.org/10.1016/j.ejphar.2021.174285openalex-snapshot

New contributions to the drug profile of TNFα inhibitor SPD304: Affinity, selectivity and ADMET considerations

inferred← citeshttps://doi.org/10.1016/j.pep.2012.09.002openalex-snapshot

Optimization of TNF-α overexpression in Escherichia coli using response surface methodology: Purification of the protein and oligomerization studies

inferred← citeshttps://doi.org/10.1021/acs.chemrestox.5b00017openalex-snapshot

Site of Reactivity Models Predict Molecular Reactivity of Diverse Chemicals with Glutathione

inferred← citeshttps://doi.org/10.1021/acs.jcim.2c01458openalex-snapshot

Structure-Based Drug Design and Synthesis of Pyrrolidine-2,5-diones as Novel TNF-α Inhibitors

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.0c00377openalex-snapshot

Discovery of an Orally Active Small-Molecule Tumor Necrosis Factor‑α Inhibitor

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.0c01316openalex-snapshot

Discovery of Small-Molecule Inhibitors of Receptor Activator of Nuclear Factor-κB Ligand with a Superior Therapeutic Index

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.1c02198openalex-snapshot

Discovery of First-in-Class TAK1–MKK3 Protein–Protein Interaction (PPI) Inhibitor (R)-STU104 for the Treatment of Ulcerative Colitis through Modulating TNF-α Production

inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c01625openalex-snapshot

Discovery of Lenacapavir: First-in-Class Twice-Yearly Capsid Inhibitor for HIV-1 Treatment and Pre-exposure Prophylaxis

inferred← citeshttps://doi.org/10.1021/acs.orglett.2c03100openalex-snapshot

Iridium-Catalyzed Asymmetric Cascade Allylation/Lactonization of Indole Esters: Access to Chiral Tricyclic Oxazinoindolones

inferred← citeshttps://doi.org/10.1021/jm300065hopenalex-snapshot

Mechanism-Based Inactivation (MBI) of Cytochrome P450 Enzymes: Structure–Activity Relationships and Discovery Strategies To Mitigate Drug–Drug Interaction Risks

inferred← citeshttps://doi.org/10.1021/ml500204eopenalex-snapshot

Quantification of the Effects of Ionic Strength, Viscosity, and Hydrophobicity on Protein–Ligand Binding Affinity

inferred← citeshttps://doi.org/10.1021/tx100124kopenalex-snapshot

The Inhaled Glucocorticoid Fluticasone Propionate Efficiently Inactivates Cytochrome P450 3A5, a Predominant Lung P450 Enzyme

inferred← citeshttps://doi.org/10.1039/c1cc10715aopenalex-snapshot

A new three-component reaction: green synthesis of novel isoindolo[2,1-a]quinazoline derivatives as potent inhibitors of TNF-α

inferred← citeshttps://doi.org/10.1039/c5md00023hopenalex-snapshot

Synthesis and biological evaluation of potential small moleculeinhibitors of tumor necrosis factor

inferred← citeshttps://doi.org/10.1039/c6ob00824kopenalex-snapshot

Synthesis of tumor necrosis factor α for use as a mirror-image phage display target

inferred← citeshttps://doi.org/10.1080/03602532.2019.1655570openalex-snapshot

Bioactivation of herbal constituents: mechanisms and toxicological relevance

inferred← citeshttps://doi.org/10.1080/07391102.2020.1831962openalex-snapshot

Ligand-based pharmacophore modeling of TNF-α to design novel inhibitors using virtual screening and molecular dynamics

inferred← citeshttps://doi.org/10.1080/15287394.2012.697810openalex-snapshot

Molecular Docking Studies of Disubstituted Diaryl Diselenides as Mammalian δ-Aminolevulinic Acid Dehydratase Enzyme Inhibitors

inferred← citeshttps://doi.org/10.1093/hmg/ddr510openalex-snapshot

A RANKL G278R mutation causing osteopetrosis identifies a functional amino acid essential for trimer assembly in RANKL and TNF

inferred← citeshttps://doi.org/10.1093/protein/gzu055openalex-snapshot

Subunit disassembly and inhibition of TNFα by a semi-synthetic bicyclic peptide

inferred← citeshttps://doi.org/10.1111/j.1747-0285.2009.00899.xopenalex-snapshot

Structure‐based Drug Metabolism Predictions for Drug Design

inferred← citeshttps://doi.org/10.1124/dmd.107.017897openalex-snapshot

Mechanism-Based Inactivation of Lung-Selective Cytochrome P450 CYP2F Enzymes

inferred← citeshttps://doi.org/10.1124/dmd.108.022707openalex-snapshot

Dehydrogenation of the Indoline-Containing Drug 4-Chloro-N-(2-methyl-1-indolinyl)-3-sulfamoylbenzamide (Indapamide) by CYP3A4: Correlation with in Silico Predictions

inferred← citeshttps://doi.org/10.1124/dmd.109.027300openalex-snapshot

The Pneumotoxin 3-Methylindole Is a Substrate and a Mechanism-Based Inactivator of CYP2A13, a Human Cytochrome P450 Enzyme Preferentially Expressed in the Respiratory Tract

inferred← citeshttps://doi.org/10.1124/dmd.114.057414openalex-snapshot

Metabolic Activation of the Indoloquinazoline Alkaloids Evodiamine and Rutaecarpine by Human Liver Microsomes: Dehydrogenation and Inactivation of Cytochrome P450 3A4

inferred← citeshttps://doi.org/10.1124/jpet.120.000270openalex-snapshot

Refined Prediction of Pharmacokinetic Kratom-Drug Interactions: Time-Dependent Inhibition Considerations

inferred← citeshttps://doi.org/10.1126/scisignal.abi8713openalex-snapshot

An orally active, small-molecule TNF inhibitor that disrupts the homotrimerization interface improves inflammatory arthritis in mice

inferred← citeshttps://doi.org/10.1177/2472555217712507openalex-snapshot

Aqueous Solubility Enhancement for Bioassays of Insoluble Inhibitors and QSPR Analysis: A TNF-α Study

inferred← citeshttps://doi.org/10.1371/journal.pcbi.1005372openalex-snapshot

Cheminformatics-aided discovery of small-molecule Protein-Protein Interaction (PPI) dual inhibitors of Tumor Necrosis Factor (TNF) and Receptor Activator of NF-κB Ligand (RANKL)

inferred← citeshttps://doi.org/10.2174/1389557519666190130163708openalex-snapshot

Ultrasound Assisted Synthesis of 3-(het)aryl Isocoumarin Derivatives and their in vitro Pharmacological Evaluation

inferred← citeshttps://doi.org/10.3389/fchem.2018.00098openalex-snapshot

Design, Synthesis, and Evaluation of Dihydrobenzo[cd]indole-6-sulfonamide as TNF-α Inhibitors

inferred← citeshttps://doi.org/10.3389/fphar.2018.00800openalex-snapshot

In Silico Discovery of Plant-Origin Natural Product Inhibitors of Tumor Necrosis Factor (TNF) and Receptor Activator of NF-κB Ligand (RANKL)

inferred← citeshttps://doi.org/10.3390/biomedicines9091250openalex-snapshot

A Novel Competitive Binding Screening Assay Reveals Sennoside B as a Potent Natural Product Inhibitor of TNF-α

inferred← citeshttps://doi.org/10.70675/233ae09bzdb65z4aefzb47dzfe949ddce13eopenalex-snapshot

Conception, synthèse, pharmacomodulation et évaluation biologique de petites molécules inhibitrices du TNFα

Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.