Tan Lab | DSigDB

Gene Set: D4 : TTD - Oxotremorine

Collection

D4 : TTD

Chemical Name

Oxotremorine ( From PubChem : OXOTREMORINE )

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
206.284 g/mol	0	3	0.5838	True

Structure

InChI

InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2

InChIKey

Links

Gene (10 / 25)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Agonist			CHRM2		Successful target
TTD	Inhibitor			SQLE		Successful target
PubChem	None	uM		CHRM1	-	GI(Protien) :
PubChem	None	uM		CHRM1	-	GI(Protien) :
PubChem	None	uM		CHRM4	-	GI(Protien) :
PubChem	None	uM		CHRM4	-	GI(Protien) :
PubChem	None	uM		CHRM5	-	GI(Protien) :
PubChem	None	uM		CHRM5	-	GI(Protien) :
PubChem	Potency	uM	0.159	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	1.995	CYP2C9	-	GI(Protien) :
PubChem	None	uM		CYP2C9	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	None	uM		MCOLN3	-	GI(Protien) :
PubChem	None	uM		MCOLN3	-	GI(Protien) :
PubChem	None	uM		MRGPRX1	-	GI(Protien) :
PubChem	None	uM		MRGPRX1	-	GI(Protien) :
PubChem	None	uM		MRGPRX1	-	GI(Protien) :
ChEMBL	AC50	nM	158.490	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	158.500	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	1995.260	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	1995.300	CYP2C9	-	Target : CHEMBL3397
ChEMBL	AC50	nM	7943.280	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	7943.300	CYP2D6	-	Target : CHEMBL289

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