Details of the Drug-Related molecule(s) Expression Atlas

General Information of Drug (ID: DMGSTKZ)

Drug Name

1,2-Bis-(3-nitro-phenyl)-ethane-1,2-dione Drug Info

Synonyms

3,3'-Dinitrobenzil; 3,5'-Dinitrobenzil; Benzil, 3,5'-dinitro-; Bis(m-nitrophenyl)ethanedione; 1,2-bis(3-nitrophenyl)ethane-1,2-dione; 5913-06-4; Ethanedione, bis(3-nitrophenyl)-; NSC 408976; BRN 2003620; 1,2-bis{3-nitrophenyl}-1,2-ethanedione; AI3-61771; NSC408976; Benzil,5'-dinitro-; AC1L2QPJ; Bis-(m,m'-nitrobenzil); Benzil-based compound, 29; AC1Q5B0Z; SCHEMBL2156825; CHEMBL191796; BDBM22751; CTK7F3460; DTXSID90207869; MolPort-003-803-953; ZINC1601014; NSC-408976; 1,2-Bis(m-nitrophenyl)ethane-1,2-dione; LS-32448; Ethanedione, bis(3

Indication

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

Cross-matching ID

PubChem CID: 101375
CAS Number: CAS 5913-06-4
TTD Drug ID: DMGSTKZ

Molecule(s) Related to This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Liver carboxylesterase (CES1)	TTMF541	EST1_HUMAN	Inhibitor	[1]

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The Expression Level of Molecule(s) in Normal Tissue of Major ADME-Related Organs

Molecule	Molecule Type	Gene Name	Liver	Colon	Kidney	Small Intestine
Liver carboxylesterase (CES1)	DTT	CES1	12.04	6.525	5.311	5.909

Molecule Expression Atlas in Normal Tissue of Major ADME-related organs

The Expression Level of Molecule(s) between Disease Section and Healthy Individual Tissue

The Studied Disease

Discovery agent

ICD Disease Classification

N.A.

Molecule Name	Molecule Type	Gene Name	p-value	Fold-Change	Z-score
Liver carboxylesterase (CES1)	DTT	CES1	3.82E-08	1.86	1.9

Molecular Expression Atlas between Disease Section and Healthy Individual Tissue

References

1	Identification and characterization of novel benzil (diphenylethane-1,2-dione) analogues as inhibitors of mammalian carboxylesterases. J Med Chem. 2005 Apr 21;48(8):2906-15.