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

General Information of Drug (ID: DMJ91Y7)

Drug Name

NSC-23180 Drug Info

Synonyms

2-nitrophenanthrene-9,10-dione; 2-Nitro-9,10-phenanthrenedione; 604-95-5; 9,10-Phenanthrenedione, 2-nitro-; NSC-23180; CHEMBL433282; NSC23180; 9, 2-nitro-; 2-nitro-9,10-dihydrophenanthrene-9,10-dione; NSC5425; 2-nitro-9,10-phenanthrenequinone; 2-Nitrophenanthraquinone; AC1Q1ZPU; AC1Q1Y4O; SCHEMBL2599395; AC1L3T23; BDBM22858; CTK8D5611; DTXSID90209161; MolPort-000-824-665; 1,2-Dione-Based Compound, 15; ZINC1686937; NSC-5425; STK246885; AKOS001483088; MCULE-2114795800; BP-22843; SR-01000388930

Indication

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

Cross-matching ID

PubChem CID: 94860
CAS Number: CAS 604-95-5
TTD Drug ID: DMJ91Y7

Molecule(s) Related to This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Acetylcholinesterase (AChE)	TT1RS9F	ACES_HUMAN	Inhibitor	[1]
Cholinesterase (BCHE)	TTEB0GD	CHLE_HUMAN	Inhibitor	[1]
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
Acetylcholinesterase (AChE)	DTT	ACHE	1.678	1.926	1.766	5.252

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
Acetylcholinesterase (AChE)	DTT	ACHE	6.39E-02	-1.07	-1.15

Molecular Expression Atlas between Disease Section and Healthy Individual Tissue

References

1	Planarity and constraint of the carbonyl groups in 1,2-diones are determinants for selective inhibition of human carboxylesterase 1. J Med Chem. 2007 Nov 15;50(23):5727-34.