Details of the Drug

General Information of Drug (ID: DMXYWD7)

• Drug Name: FARNESYL
• Synonyms: FARNESYL; (6E,10E)-2,6,10-trimethyldodeca-2,6,10-triene; 2,6E,10E-Trimethyl-2,6,10-dodecatriene; CHEBI:36534; 2,6,10-trimethyldodeca-2,6,10-triene; 2,6,10-Farnesatriene; AC1L9FQ4; CHEBI:42362; LMFA11000034; (2E)-3,7,11-Trimethyl-2,6,10-dodecatriene; (6E)-3,7,11-Trimethyl-2,6,10-dodecatriene; (2E,6E)-3,7,11-Trimethyl-2,6,10-dodecatriene; (6E,10E)-2,6,10-trimethyl-dodeca-2,6,10-triene

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); 206.37
  Logarithm of the Partition Coefficient (xlogp); 6
  Rotatable Bond Count (rotbonds); 6
  Hydrogen Bond Donor Count (hbonddonor); 0
  Hydrogen Bond Acceptor Count (hbondacc); 0
• Chemical Identifiers:
  Formula: C15H26
  IUPAC Name: (6E,10E)-2,6,10-trimethyldodeca-2,6,10-triene
  Canonical SMILES: C/C=C(\\C)/CC/C=C(\\C)/CCC=C(C)C
  InChI: InChI=1S/C15H26/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,7-8,10-11H2,1-5H3/b14-6+,15-12+
  InChIKey: JXBSHSBNOVLGHF-BUJBXKITSA-N
• Cross-matching ID:
  PubChem CID: 444108
  ChEBI ID: CHEBI:36534
  TTD ID: D01DTW

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
CAAX farnesyltransferase beta (FNTB)	TT7WZIJ	FNTB_HUMAN	Inhibitor	[1]
Farnesyl protein transferase (Ftase)	TTXQKM3	FNTA_HUMAN ; FNTB_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
Farnesyl protein transferase (Ftase)	DTT	FNTB; FNTA	5.43E-01	-0.1	-0.4

References

• [1] The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.