Tan Lab | DSigDB

Gene Set: D4 : CTD - Domperidone

Collection

D4 : CTD

Chemical Name

Domperidone ( From PubChem : DOMPERIDONE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
425.911 g/mol	2	5	3.2911	True

Structure

InChI

InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)

InChIKey

FGXWKSZFVQUSTL-UHFFFAOYSA-N

Links

Gene (21 / 38)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(response to substance)			ABCB1		D004294
CTD	affects(response to substance)			ADRA1D		D004294
CTD	increases(expression)			CYP1A1		D004294
CTD	increases(hydroxylation)			CYP1A2		D004294
CTD	increases(hydroxylation)			CYP2B6		D004294
CTD	increases(hydroxylation)			CYP2C8		D004294
CTD	increases(hydroxylation)			CYP2D6		D004294
CTD	decreases(alkylation)			CYP3A4		D004294
CTD	increases(hydroxylation)			CYP3A4		D004294
CTD	decreases(expression)			IL6		D004294
CTD	decreases(reaction)			KCNH2		D004294
CTD	increases(transport)			KCNH2		D004294
CTD	decreases(activity)			KCNH2		D004294
CTD	affects(response to substance)			KCNH2		D004294
CTD	decreases(expression)			PRL		D004294
CTD	decreases(reaction)			PRL		D004294
CTD	increases(expression)			PRL		D004294
CTD	decreases(reaction)			SLC22A2		D004294
CTD	increases(uptake)			SLC22A2		D004294
CTD	decreases(expression)			TGFB1		D004294
PubChem	None	uM		ALPL	-	GI(Protien) :
PubChem	None	uM		APAF1	-	GI(Protien) :
PubChem	Potency	uM	16.354	ATAD5	-	GI(Protien) :
PubChem	None	uM		BCL2L1	-	GI(Protien) :
PubChem	Potency	uM	3.162	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	None	uM		DRD2	-	GI(Protien) :
PubChem	None	uM		DRD3	-	GI(Protien) :
PubChem	Potency	uM	0.224	KCNH2		GI(Protien) :
PubChem	Potency	uM	0.224	KCNH2		GI(Protien) :
PubChem	None	uM		KCNH2	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	Potency	uM	23.715	TDP1	-	GI(Protien) :
ChEMBL	Potency	nM	16353.500	ATAD5	-	Target : CHEMBL1741209
ChEMBL	AC50	nM	3162.280	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	7943.300	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	3162.300	CYP2D6	-	Target : CHEMBL289

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