Details of the Drug

General Information of Drug (ID: DMELSV1)

• Drug Name: 1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one
• Synonyms: CHEMBL225618; 3,3',4,4'-tetrahydroxychalcone; 1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one; SCHEMBL109015; BDBM50157562; 3,3'',4,4''-tetrahydroxychalcone; ZINC13541162

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 272.25
  Logarithm of the Partition Coefficient (xlogp); 2.3
  Rotatable Bond Count (rotbonds); 3
  Hydrogen Bond Donor Count (hbonddonor); 4
  Hydrogen Bond Acceptor Count (hbondacc); 5
• Chemical Identifiers:
  Formula: C15H12O5
  IUPAC Name: (E)-1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one
  Canonical SMILES: C1=CC(=C(C=C1/C=C/C(=O)C2=CC(=C(C=C2)O)O)O)O
  InChI: InChI=1S/C15H12O5/c16-11(10-3-6-13(18)15(20)8-10)4-1-9-2-5-12(17)14(19)7-9/h1-8,17-20H/b4-1+
  InChIKey: DOWSJIIZLUFMFM-DAFODLJHSA-N
• Cross-matching ID:
  PubChem CID: 10038861
  TTD ID: D0Y2RR

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
TERT messenger RNA (TERT mRNA)	TTQY2EJ	TERT_HUMAN	Inhibitor	[1]

References

• [1] Catecholic flavonoids acting as telomerase inhibitors. J Med Chem. 2004 Dec 16;47(26):6466-75.