Theobromine

DB01412InvestigationalSmall molecule

Theobromine (3,7-dimethylxanthine) is the principle alkaloid in Theobroma cacao (the cacao bean) and other plants. A xanthine alkaloid that is used as a bronchodilator and as a vasodilator. It has... It has a weaker diuretic activity than theophylline and is also a less powerful stimulant of smooth muscle.

Chemical structure of Theobromine
Mechanism
Curator reviewed
Primary indication
theobromine is used as a vasodilator, a diuretic, and heart stimulant.Curator reviewed
Formula / weight
C7H8N4O2 · 180.164 g/mol (avg)
Also known as
3,7-dimethylxanthine
Code names
FEMA NO. 3591 · NSC-5039 · SC-15090

Resolves to

Structure
InChIKeyYAPQBXQYLJRXSA-UHFFFAOYSA-NSMILESCN1C=NC2=C1C(=O)NC(=O)N2C

What you can answer from here — as of September 23, 2026

4Protein targetsEach mapped to UniProt, with action and pharmacological action
Listed above
1,123Drug interactionsStructured to mechanism, not free text
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2Clinical trialsPhase, status and sponsor resolved per trial
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3ATC codesIncluding every combination product, plus 18 drug categories
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28+ReferencesStructured and connected to the statements they support
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Which drugs share a target with Theobromine, and which of those have an active Phase 3 trial?

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