Tan Lab | DSigDB

Gene Set: D1 - Approved - AMITRIPTYLINE HYDROCHLORIDE

Collection

D1 : Approved

Chemical Name

AMITRIPTYLINE HYDROCHLORIDE

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
313.864 g/mol	1	1	4.9706	True

Structure

InChI

InChI=1S/C20H23N.ClH/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20;/h3-6,8-12H,7,13-15H2,1-2H3;1H

InChIKey

Links

Gene (15 / 21)

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Source	Type	Unit	Value	Gene	PMID	Other
PubChem	Potency	uM	17.783	ALDH1A1	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	61.131	AR	-	GI(Protien) :
PubChem		uM		CHRM1	-	GI(Protien) :
PubChem		uM		CHRM4	-	GI(Protien) :
PubChem		uM		CHRM5	-	GI(Protien) :
PubChem		uM		DRD1	-	GI(Protien) :
PubChem		uM		DRD2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	10.350	ESR1	-	GI(Protien) :
PubChem	Potency	uM	54.948	ESR1	-	GI(Protien) :
PubChem	Potency	uM	19.953	GNAS	-	GI(Protien) :
PubChem	Potency	uM	15.849	KCNH2		GI(Protien) :
PubChem	Potency	uM	15.849	KCNH2		GI(Protien) :
PubChem		uM		SLC6A2	-	GI(Protien) :
PubChem		uM		SLC6A4	-	GI(Protien) :
PubChem	Potency	uM	23.715	TDP1	-	GI(Protien) :
PubChem	Potency	uM	26.609	TDP1	-	GI(Protien) :
PubChem		uM		TLR3	-	GI(Protien) :
PubChem	Potency	uM	61.131	TP53	-	GI(Protien) :
ChEMBL	Potency	nM	17782.800	ALDH1A1	-	Target : CHEMBL3577
ChEMBL	Potency	nM	19952.600	GNAS	-	Target : CHEMBL4377
ChEMBL	Potency	nM	15848.900	KCNH2	-	Target : CHEMBL240

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