Details of the Drug

General Information of Drug (ID: DM97GFB)

• Drug Name: (2,5-Diphenyl-furan-3-yl)-phenyl-methanone
• Synonyms: 2,5-Diphenyl-3-benzoylfuran; CHEMBL109280; (2,5-Diphenyl-furan-3-yl)-phenyl-methanone

Indication

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

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 1:
  Molecular Weight (mw); 324.4
  Logarithm of the Partition Coefficient (xlogp); 5.7
  Rotatable Bond Count (rotbonds); 4
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 2
• Chemical Identifiers:
  Formula: C23H16O2
  IUPAC Name: (2,5-diphenylfuran-3-yl)-phenylmethanone
  Canonical SMILES: C1=CC=C(C=C1)C2=CC(=C(O2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4
  InChI: InChI=1S/C23H16O2/c24-22(18-12-6-2-7-13-18)20-16-21(17-10-4-1-5-11-17)25-23(20)19-14-8-3-9-15-19/h1-16H
  InChIKey: QGPDONYUANCEMJ-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 44339577
  TTD ID: D0W7BI

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Phosphodiesterase 4A (PDE4A)	TTZ97H5	PDE4A_HUMAN	Inhibitor	[1]

Molecular Expression Atlas of This Drug

• The Studied Disease: Discovery agent
• ICD Disease Classification: N.A.

Molecule Name	Molecule Type	Gene Name	p-value	Fold-Change	Z-score
Phosphodiesterase 4A (PDE4A)	DTT	PDE4A	9.26E-01	-3.01E-03	-0.01

References

• [1] Substituted furans as inhibitors of the PDE4 enzyme. Bioorg Med Chem Lett. 1999 Feb 8;9(3):323-6.