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⚗️ Ingredient

Theophylline

37
Clinical Trials
5
Meta-Analyses
2
PubMed References
📋 Sample Trials
NCT00983905
Drug-Drug Interaction Study of Colchicine and Theophylline
Completed · Phase 1
NCT01601132
Drug Interaction Study of Colchicine and Theophylline
Completed · Phase 4
NCT00003684
Theophylline in Treating Cancer Patients With Shortness of Breath
Completed · Phase 3
📊 Sample Meta-Analyses
CRD42022304383
The diuretic effect of aminophylline or theophylline in adjunct with furosemide in paediatric populations: a systematic review and meta-analysis
The use of aminophylline or theophylline in adjunct with furosemide in paediatri
CRD42015026600
What is the optimum therapeutic range for theophyllines in children?
Asthma in children
CRD42021224952
Adding theophylline to ICS therapy on COPD: a protocol for systematic review and meta-analysis
Chronic obstructive pulmonary disease (COPD) is a common and frequently occurrin
📚 Sample References
PMID 24841445
Lung injury after simulated cardiopulmonary bypass in an isolated perfused rat lung preparation: Role of mitogen-activated protein kinase/Akt signaling and the effects of theophylline
J Thorac Cardiovasc Surg · 2014
PMID 32001318
Theophylline enhances melanogenesis in B16F10 murine melanoma cells through the activation of the MEK 1/2, and Wnt/β-catenin signaling pathways
Food Chem Toxicol · 2020
⚗️ All Ingredient data fields for Theophylline
⚗️ Identity
Name
Theophylline
Aliases / Synonyms
58-55-9; 1,3-Dimethylxanthine; Elixophyllin; Theophylline anhydrous; Theophyllin; Theolair; Nuelin; Respbid; Theocin
🧪 Chemistry
Molecular Weight
180.1670
LogP
-1.0397
Drug-likeness
0.562
H-Bond Acceptors
5
H-Bond Donors
1
🔬 Structures
Canonical SMILES
CN1C2=C(C(=O)N(C1=O)C)NC=N2
Isomeric SMILES
CN1C2=C(C(=O)N(C1=O)C)NC=N2
InChIKey
ZFXYFBGIUFBOJW-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)
🔗 External References
PubChem CID
DrugBank
NPASS
NPC252603
HIT
C0443
TCMID
21296
TCM-ID
500
🔍 Raw view — every non-empty column on this row (31 fields)
name
Theophylline
common names
58-55-9; 1,3-Dimethylxanthine; Elixophyllin; Theophylline anhydrous; Theophyllin; Theolair; Nuelin; Respbid; Theocin
herb ingredient id
HBIN046282
canonical smiles
CN1C2=C(C(=O)N(C1=O)C)NC=N2
isomeric smiles
CN1C2=C(C(=O)N(C1=O)C)NC=N2
inchi
InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)
inchikey
ZFXYFBGIUFBOJW-UHFFFAOYSA-N
mol wt
180.1670
num h acceptors
5
num h donors
1
mol logp
-1.0397
num rotatable bonds
0
drug likeness
0.562
tcmid ingredient id
21296
tcm id ingredient id
500
pubchem cid
2153
drugbank id
DB00277
npass id
NPC252603
hit id
C0443

📋 Clinical Trials

12 · subject of clinical study
NCT00983905 Drug-Drug Interaction Study of Colchicine and Theophylline
→ Pharmacokinetics
NCT01601132 Drug Interaction Study of Colchicine and Theophylline
→ Healthy
NCT00003684 Theophylline in Treating Cancer Patients With Shortness of Breath
→ Pulmonary Complications|Quality of Life|Unspecifie
NCT00003808 Theophylline in Treating Patients With In Situ, Stage I, or Stage II Chronic Lym
→ Leukemia
NCT00119496 Rosiglitazone Versus Theophylline in Asthmatic Smokers
→ Asthma
NCT00299858 Theophylline in Chronic Obstructive Pulmonary Disease
→ COPD
NCT00492518 Acetylcysteine, Theophylline, and a Combination of Both in the Prophylaxis of Co
→ Contrast Induced Nephropathy|Kidney Diseases|Renal
NCT00671151 Effects of Low-Dose Theophylline During Chronic Obstructive Pulmonary Disease (C
→ COPD
NCT00779259 Drug - Drug Interaction Study Between Quinine Sulfate and Theophylline
→ Pharmacokinetics
NCT01017939 A Drug-Drug Interaction Study of Abiraterone Acetate Plus Prednisone With Dextro
→ Prostate Neoplasms
NCT01132781 Theophylline in Rhinitis
→ Rhinosinusitis|Asthma|Allergic Rhinitis
NCT01263106 A Study of LY2216684 and Theophylline in Healthy Subjects
→ Major Depressive Disorder

📊 Meta-Analyses

5 · systematic review
CRD42022304383 The diuretic effect of aminophylline or theophylline in adjunct with furosemide
→ The use of aminophylline or theophylline in adjunc
CRD42015026600 What is the optimum therapeutic range for theophyllines in children?
→ Asthma in children
CRD42021224952 Adding theophylline to ICS therapy on COPD: a protocol for systematic review and
→ Chronic obstructive pulmonary disease (COPD) is a
CRD42017082794 Oral xanthine derivatives (theophylline and doxofylline) for patients with stabl
→ The Cochrane Airways Group
CRD42020196001 Effect of Low-dose Oral Theophylline as Additional Treatment on Exacerbations in
→ Theophylline, the most commonly used methylxanthin

📚 PubMed References

2 · cited research
PMID 24841445 Lung injury after simulated cardiopulmonary bypass in an isolated perfused rat l
J Thorac Cardiovasc Surg
PMID 32001318 Theophylline enhances melanogenesis in B16F10 murine melanoma cells through the
Food Chem Toxicol
How relationships are computed
  • Clinical Trials / Meta-Analyses / References: direct foreign-key link via subject_entity_id (Phase 2d wireup)
  • Formula ↔ Herbs: text bridge via formulas.herbs_in_pinyin matching herbs.pinyin_name
  • Herb ↔ Ingredient: empty — needs HERB_herb_ingredient import
  • Ingredient ↔ Target: empty — needs HERB_ingredient_target import
  • Target ↔ Disease: empty — needs HERB_target_disease import
  • Herb → Target → Disease (full chemical spine): awaiting Phase 2e link tables