Table of Contents

Caffeine 2600μM R08 exp463

Mechanism of Action

CNS stimulant, antagonist of adenosine receptors, inhibits phosphodiesterases, modulates intracellular calcium

Technical Notes

Protein References

  • PubChem Name: Caffeine
  • Synonyms: N/A
  • CAS #: 58-08-2
  • PubChem CID: 2519
  • IUPAC: 1,3,7-trimethylpurine-2,6-dione
  • INCHI Name: InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
  • INCHI Key: RYYVLZVUVIJVGH-UHFFFAOYSA-N
  • Molecular Weight: 194.19
  • Canonical SMILES: CN1C=NC2=C1C(=O)N(C(=O)N2C)C
  • Isomeric SMILES: N/A
  • Molecular Formula: C8H10N4O2

Protein Supplier

  • Supplier Name: Combi-Blocks
  • Catalog #: QE-5365
  • Lot #: A39397

Protein Characterization

  • HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C8H10N4O2 195.08765; found 195.08772

Dose Response Curve

  • Platform ID: Caffeine
  • Min: 2.4949; Max: 86.2839





IC Concentration (µM)
IC10 1086.0000
IC20 1832.0000
IC30 2593.0000
IC40 3448.0000
IC50 4478.0000
IC60 5817.0000
IC70 7734.0000
IC80 10950.0000
IC90 N/A


Screen Summary

Screen Results

Sensitive/Resistant hits (FDR<0.05)CRANKSScore PlotTop 30 GenesScreen SimilarityTop 30 Sensitive GO termsTop 30 Resistant GO terms
9/0ScoresViewViewViewViewView