Details of the Drug

General Information of Drug (ID: DM35NF6)

• Drug Name: SRI-224
• Synonyms: SRI-224; CHEMBL223505; [(E)-1-(4-methoxyphenyl)ethylideneamino]thiourea; p-Methoxyacetophenone thiosemicarbazone; 1-(4-methoxyphenyl)ethanone thiosemicarbazone; MolPort-000-248-698; ZINC15224175; BDBM50302754; AKOS000506378; p-methoxyphenyl(methyl)thiosemicarbazone; KB-89903; ST085316; BAS 00232870; 9P-047; SR-01000310617; [(E)-[1-(4-methoxyphenyl)ethylidene]amino]thiourea; SR-01000310617-1; (1E)-1-(4-methoxyphenyl)ethanone thiosemicarbazone

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); 223.3
  Logarithm of the Partition Coefficient (xlogp); 1.4
  Rotatable Bond Count (rotbonds); 3
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C10H13N3OS
  IUPAC Name: [(E)-1-(4-methoxyphenyl)ethylideneamino]thiourea
  Canonical SMILES: C/C(=N\\NC(=S)N)/C1=CC=C(C=C1)OC
  InChI: InChI=1S/C10H13N3OS/c1-7(12-13-10(11)15)8-3-5-9(14-2)6-4-8/h3-6H,1-2H3,(H3,11,13,15)/b12-7+
  InChIKey: JPXKIPVPEBSPLT-KPKJPENVSA-N
• Cross-matching ID:
  PubChem CID: 9561005
  TTD ID: D02JWY

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Tyrosinase (TYR)	TTULVH8	TYRO_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
Tyrosinase (TYR)	DTT	TYR	6.68E-04	2.54	1.15

References

• [1] Discovery of 4-functionalized phenyl-O-beta-D-glycosides as a new class of mushroom tyrosinase inhibitors. Bioorg Med Chem Lett. 2009 Nov 1;19(21):6157-60.