Details of the Drug

General Information of Drug (ID: DM9O0AR)

• Drug Name: SB-13
• Synonyms: CARBAMIC ACID, DIMETHYL-, 2-(DIMETHYLAMINO)-p-TOLYL ESTER, HYDROCHLORIDE; Carbamic acid, N,N-dimethyl-, 2-dimethylamino-4-methylphenyl ester, hydrochloride; AC1L2CX4; LS-49497; 63884-75-3; [2-(dimethylcarbamoyloxy)-5-methylphenyl]-dimethylazanium chloride

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); 225.28
  Logarithm of the Partition Coefficient (xlogp); 3.8
  Rotatable Bond Count (rotbonds); 3
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 2
• Chemical Identifiers:
  Formula: C15H15NO
  IUPAC Name: 4-[(E)-2-[4-(methylamino)phenyl]ethenyl]phenol
  Canonical SMILES: CNC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)O
  InChI: InChI=1S/C15H15NO/c1-16-14-8-4-12(5-9-14)2-3-13-6-10-15(17)11-7-13/h2-11,16-17H,1H3/b3-2+
  InChIKey: ZWIARAQZLULYPG-NSCUHMNNSA-N
• Cross-matching ID:
  PubChem CID: 10013901
  CAS Number: 866475-34-5
  TTD ID: D0I8XD

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Amyloid beta A4 protein (APP)	TTE4KHA	A4_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
Amyloid beta A4 protein (APP)	DTT	APP	1.60E-02	-0.07	-0.31

References

• [1] Synthesis of biphenyltrienes as probes for beta-amyloid plaques. J Med Chem. 2006 May 4;49(9):2841-4.