Details of the Drug | DrugMAP

General Information of Drug (ID: DM9C5Z8)

Drug Name	Selenium compound 1
Synonyms	PMID25468267-Compound-28
Drug Type	Small molecular drug
Structure
Structure	3D MOL			2D MOL
#Ro5 Violations (Lipinski): 0	Molecular Weight			189.08
	Logarithm of the Partition Coefficient			Not Available
	Rotatable Bond Count			1
	Hydrogen Bond Donor Count			1
	Hydrogen Bond Acceptor Count			2
Chemical Identifiers	Formula C6H6O2Se IUPAC Name benzeneseleninic acid Canonical SMILES C1=CC=C(C=C1)[Se](=O)O InChI InChI=1S/C6H6O2Se/c7-9(8)6-4-2-1-3-5-6/h1-5H,(H,7,8) InChIKey WIHKGDVGLJJAMC-UHFFFAOYSA-N
Cross-matching ID	PubChem CID 23427 CAS Number 6996-92-5 TTD ID D0X2AU

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Lysine-specific demethylase 4A (KDM4A)	TTZHPB8	KDM4A_HUMAN	Inhibitor	[1]

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Molecular Interaction Atlas (MIA)

Jump to Detail Molecular Interaction Atlas of This Drug

References

1	KDM4 histone demethylase inhibitors for anti-cancer agents: a patent review.Expert Opin Ther Pat. 2015 Feb;25(2):135-44.