Tan Lab | DSigDB

Gene Set: D4 : CTD - diacetylmonoxime

Collection

D4 : CTD

Chemical Name

diacetylmonoxime ( From PubChem : DIACETYL MONOXIME )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Not	Not	Not	Not	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
101.104 g/mol	1	3	0.4255	True

Structure

InChI

InChI=1S/C4H7NO2/c1-3(5-7)4(2)6/h7H,1-2H3/b5-3+

InChIKey

FSEUPUDHEBLWJY-HWKANZROSA-N

Links

Gene (8 / 19)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(binding)			ACHE		C004717
CTD	decreases(activity)			ACHE		C004717
CTD	decreases(reaction)			ACHE		C004717
CTD	decreases(activity)			ACHE		C004717
CTD	decreases(reaction)			ACHE		C004717
CTD	affects(localization)			ACTA2		C004717
CTD	decreases(reaction)			CASP3		C004717
CTD	increases(activity)			CASP3		C004717
CTD	decreases(uptake)			TF		C004717
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	3.981	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :
ChEMBL	AC50	nM	7943.280	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	7943.300	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	3981.070	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	3981.100	CYP2D6	-	Target : CHEMBL289

Download gene sets

gmt, text, Detailed text

Contact us
Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA

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