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lumiracoxib

vr.tr.lumiracoxib · thing-q413744

Enable an agent to identify lumiracoxib, assess the quality and condition of a material containing it, and determine which handling or research uses have adequate evidence and authorization.

Thing Registry Physical world and living systems PHY.MAT

Bundle → Layer → Finding → Questions Filled

6 bundles · 12 layers · 18 findings · 33 questions

Lumiracoxib identity Establish the exact parent compound and distinguish it from related chemicals and product names.

Parent structure

Recognize lumiracoxib through connectivity and substitution pattern.

Structural identity test

Require agreement between the proposed lumiracoxib identity and a structure-specific reference.

  1. Does the structure contain the 2-chloro-6-fluorophenylamino group and the 5-methylphenylacetic-acid framework? definition
  2. Which reference structure and analytical observations establish that the sample is lumiracoxib rather than a related NSAID? provenance

Names and chemical boundaries

Resolve identifiers while keeping products, derivatives and metabolites distinct.

Identifier and form resolution

Attach identifiers to their documented chemical species and treat product names as contextual links.

  1. Which authoritative records connect the supplied name and CAS number to the parent lumiracoxib structure? provenance
  2. Does the record describe parent lumiracoxib, a salt, a metabolite, a mixture or a finished medicine? boundary
Lumiracoxib material quality Represent chemical form, parent-compound content and batch-specific contaminants.

Form and content

Separate chemical species, solid form and assay reporting basis.

Parent-equivalent content

Require the material form and assay basis before interpreting weighed lumiracoxib quantities.

  1. Is the material the free acid, a characterized salt or a form whose identity remains unresolved? definition
  2. What is the measured lumiracoxib content, and is it reported as received, on a dry basis or as parent equivalents? measurement

Impurities and authentication

Assess evidence that distinguishes lumiracoxib from impurities and degradation products.

Batch analytical confidence

Link identity and purity conclusions to methods, reference materials and batch records.

  1. Which chromatographic and spectroscopic results authenticate this lumiracoxib batch? provenance
  2. Which related substances, residual solvents, water content and unidentified peaks were measured, and with what limits? measurement
  3. Does the analytical evidence satisfy the requirements of the proposed experiment or require reanalysis? action
Lumiracoxib physical state Represent condition-dependent dissolution, solid-state behavior and stability.

Ionization and dissolution

Assess the conditions under which lumiracoxib is dissolved and chemically interpretable.

Verified solution state

Distinguish weighed loading from measured dissolved parent compound.

  1. What measured pKa and solubility evidence applies to the specified lumiracoxib form, solvent, pH and temperature? measurement
  2. Does dilution into the intended assay medium cause precipitation or a change in dissolved concentration? measurement

Thermal and storage stability

Connect lumiracoxib condition to thermal characterization and storage history.

Condition-supported usability

Require form-specific evidence for thermal properties, storage limits and solution lifetime.

  1. Which measured transitions correspond to melting, solvent loss or decomposition, and which lumiracoxib solid form was tested? measurement
  2. What evidence supports storage temperature, light protection and usable lifetime for this solid or solution? provenance
  3. Do excursions, freeze-thaw history or observed changes require an integrity check before use? action
Lumiracoxib biological evidence Represent COX inhibition and exposure-related evidence without converting it into prescribing instructions.

COX assay context

Make inhibition and selectivity claims conditional on the experimental system.

Comparable COX inhibition

Record target, species, preparation, endpoint and exposure conditions for each potency result.

  1. What COX-1 and COX-2 inhibition values were measured for lumiracoxib, using which assay systems and endpoints? measurement
  2. Were the measurements sufficiently matched to support the reported selectivity ratio and its direction? boundary

Exposure and metabolite boundaries

Separate parent-compound exposure from administered amount and metabolite observations.

Parent exposure interpretation

Link pharmacokinetic and metabolism observations to their biological context and measured chemical species.

  1. Which species, matrix, route and sampling conditions support the reported lumiracoxib exposure or clearance? provenance
  2. Does the analytical result quantify parent lumiracoxib, unbound parent, a named metabolite or combined drug-related material? boundary
Lumiracoxib safety and permissions Connect hepatic safety evidence, material hazards and dated restrictions to proposed activities.

Hepatic safety evidence

Preserve the serious liver-risk signal and the limits of risk prediction.

Liver risk and uncertainty

EMA recommended withdrawal of lumiracoxib-containing medicines in December 2007 following its assessment of serious liver effects. [EMA recommendation](https://www.ema.europa.eu/en/news/european-medicines-agency-recommends-withdrawal-marketing-authorisations-lumiracoxib-containing-medicines)

  1. Which primary studies and regulatory assessments establish the liver-injury outcomes and exposure contexts? provenance
  2. Which proposed metabolic mechanisms or susceptibility markers are supported, and which remain hypotheses? boundary

Laboratory material hazards

Determine handling requirements for the actual lumiracoxib preparation.

Preparation-specific handling

Use applicable hazard documentation for solid lumiracoxib or its particular solution rather than translating clinical risk directly into a GHS classification.

  1. Which current safety data sheet supplies the applicable GHS classification and handling requirements for this preparation? provenance
  2. Are lumiracoxib-specific exposure limits established, and what documented controls apply where limits are unavailable? action
  3. Which solvent hazards and waste requirements additionally apply to a lumiracoxib solution? action

Jurisdiction and use status

Resolve permission for a defined activity using current, geographically applicable evidence.

Dated activity authorization

Keep historical withdrawal recommendations distinct from verified current decisions and their product or activity scope.

  1. Which authority and dated record establish the current status of the relevant lumiracoxib product or activity in this jurisdiction? provenance
  2. Does that record govern medicinal marketing, research procurement, import, possession or another specifically defined activity? boundary
  3. What documented conditions must be satisfied before the proposed procurement, transfer or use proceeds? action
Evidence and external alignment What the world already says about this thing, gathered so the model can be checked against it.

Reported evidence

Findings from the breadth pass, kept separate from the structural claims.

Check these first

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these check these first hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Identifiers and schemes

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these identifiers and schemes hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Real-world use

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these real-world use hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Typical measurements

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these typical measurements hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Failure modes and hazards

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these failure modes and hazards hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Regional variation

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these regional variation hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Neighbouring kinds and how to tell them apart

Recalled without web access and unsourced; every item is a lead to verify.

  1. Which of these neighbouring kinds and how to tell them apart hold for the sense of lumiracoxib this model covers, and on what evidence? provenance

Classifiers Filled

Family
Thing Registry
Category
Physical world and living systems
Entry kind
thing
Plane
PHY
Domain
PHY.MAT

What it is Filled

Lumiracoxib is a synthetic phenylacetic acid derivative and selective cyclooxygenase-2 (COX-2) inhibitor developed as a nonsteroidal anti-inflammatory drug for relief of pain and inflammation.

In scope

  • Molecular identity and identifiers distinguishing lumiracoxib from related NSAIDs
  • Free-acid identity and relationships to salts, solid forms and solutions
  • Batch purity, impurities, degradation and analytical confirmation
  • Condition-dependent physical properties and storage suitability
  • COX inhibition evidence, hepatic safety evidence and their limits
  • Dated regulatory restrictions and material-handling requirements

Out of scope

  • Finished medicinal products, their excipients, packaging and commercial identity
  • Patient diagnosis, prescribing, dosing and individualized treatment decisions
  • Manufacturing processes and synthesis-route operating instructions
  • Metabolites and related NSAIDs as independent chemical substances
  • Clinical trials, adverse-event cases and regulatory proceedings as standalone entities

Why it exists Filled

Enable an agent to identify lumiracoxib, assess the quality and condition of a material containing it, and determine which handling or research uses have adequate evidence and authorization.

Distinguishing features Filled

  • Match molecular connectivity to 2-[2-[(2-chloro-6-fluorophenyl)amino]-5-methylphenyl]acetic acid; matching a drug-class label alone is insufficient.
  • Check the parent formula C15H13ClFNO2 and PubChem CID 151166 against structural evidence. [PubChem](https://pubchem.ncbi.nlm.nih.gov/compound/Lumiracoxib)
  • Distinguish it from diclofenac through the fluorine-containing substitution pattern and additional methyl group on the phenylacetic-acid ring.
  • Distinguish it from celecoxib by its carboxylic-acid structure rather than a sulfonamide-bearing structure.
  • Distinguish a lumiracoxib material from a branded medicine or metabolite by confirming the actual chemical species and other constituents.

What robots and AI may and may not do Filled

Must not

  • Recommend, supply or dose it for a person.
  • Help obtain it from unregulated sources where it has been withdrawn.
  • Downplay the liver toxicity that led to its withdrawal.

Only with a human decision

  • Any decision about pain or arthritis treatment for a person.

May

  • Describe lumiracoxib's class as a selective COX-2 inhibitor and its regulatory history.
  • Explain that it was withdrawn in many countries because of serious liver injury.

Moral aspects Filled

  • Its history shows the duty to act on post-marketing safety signals.

Who is affected

  • Patients with arthritis or pain
  • Prescribers

Owners Filled

Steward

The marketing authorisation holder where it remains licensed; medicines regulators decide its status.

Master systems

  • National medicines registers

Links to other meta-models Filled

parent

  • Q11173 - registry parent class

What else AI and robots need to interact with it Filled

Identity and identifiers required Filled

  • Vercy registry: vr.tr.lumiracoxib
  • Wikidata: Q413744 (https://www.wikidata.org/wiki/Q413744)

Direct properties required Filled

  • Chemical identity: Parent molecular structure; formula C15H13ClFNO2; PubChem CID 151166
  • Registry identifier correspondence: vr.tr.lumiracoxib; CAS 220991-20-8; other identifiers require verification
  • Material form: Free acid, explicitly identified salt, characterized solid form, solution or unresolved form
  • Assay and impurity profile: Mass fraction or chromatographic area percentage with method and reporting basis; impurity concentrations in specified units
  • Ionization and solubility: pKa; solubility in mg/mL or mol/L with pH, solvent, temperature and material form
  • Thermal and solid-state behavior: Melting or decomposition temperature in °C; pressure, method and solid-form identification
  • COX inhibition: COX-1 and COX-2 IC50 or other explicitly identified endpoints in nM or µM, with assay conditions
  • Hepatic safety evidence: Linked studies or assessments with exposure context, outcome and uncertainty
  • Storage condition and integrity: Documented storage history; intact, degraded, expired, quarantined or unassessed
  • Applicable restrictions: Jurisdiction, authority, decision date, permitted activity, product or substance scope, and verification date

Recognition required Filled

  • Identity cannot be settled by sight; tablets must be confirmed by label and pharmacy records.

Capabilities and actions required Filled

  • Resolve a supplier or registry record to lumiracoxib using structural and identifier evidence.
  • Assess whether a batch is suitable for a specified analytical or nonclinical experiment.
  • Compare solubility, stability and COX inhibition results under compatible conditions.
  • Flag material for reanalysis or quarantine when identity, degradation or purity evidence is inadequate.
  • Determine which jurisdiction-specific checks are needed before procurement, transfer or use.
  • Trace safety and handling decisions to dated evidence while preserving unresolved questions.

Hazards and failure modes required Filled

  • Serious liver injury, including cases requiring transplantation.
  • Gastrointestinal and cardiovascular risks shared with the drug class.

Standards and interfaces required Filled

  • The Anatomical Therapeutic Chemical classification maintained by the WHO Collaborating Centre for Drug Statistics Methodology assigns lumiracoxib code M01AH06 within the coxibs.

Context of use required Filled

  • Lumiracoxib is encountered in pharmaceutical research and reference materials as a selective COX-2 inhibitor developed to relieve pain and inflammation.
  • Its association with serious liver injury makes authorization history and material provenance relevant when assessing proposed uses.

Sources Filled

  1. Wikidata item Q413744: lumiracoxib - identity and sense of the item
  2. Wikipedia: Lumiracoxib - general description of the item

Open questions

  • Which authoritative records confirm lumiracoxib's EC number, if assigned, and distinguish identifiers for the parent acid from any separately registered forms?
  • Which primary measurements establish pKa, condition-specific solubility, solid forms and thermal behavior, including whether a meaningful boiling point is available before decomposition?
  • Which impurity specifications, validated analytical methods and stability data support the intended lumiracoxib material grade?
  • What current jurisdiction-specific medicinal and research statuses, GHS classifications and occupational exposure limits can be verified?
  • How well do primary studies establish lumiracoxib's hepatic injury mechanisms and susceptibility factors, and what uncertainty remains in predicting risk?

Machine files

Provenance

thing registry research (pass 2) · unreviewed

Built from: models/things/publications/thing-q413744/spec.json