Tan Lab | DSigDB

Gene Set: D4 : CTD - Ketotifen

Collection

D4 : CTD

Chemical Name

Ketotifen ( From PubChem : KETOTIFEN )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
309.425 g/mol	0	3	3.9523	True

Structure

InChI

InChI=1S/C19H19NOS/c1-20-9-6-13(7-10-20)18-15-5-3-2-4-14(15)12-17(21)19-16(18)8-11-22-19/h2-5,8,11H,6-7,9-10,12H2,1H3

InChIKey

Links

Gene (9 / 28)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(binding)			ADRB2		D007665
CTD	decreases(reaction)			ADRB2		D007665
CTD	decreases(response to substance)			ADRB2		D007665
CTD	increases(activity)			ADRB2		D007665
CTD	affects(cotreatment)			ICAM1		D007665
CTD	decreases(expression)			ICAM1		D007665
CTD	affects(cotreatment)			IL1B		D007665
CTD	decreases(expression)			IL1B		D007665
CTD	affects(cotreatment)			SELE		D007665
CTD	decreases(expression)			SELE		D007665
CTD	decreases(reaction)			SLC22A2		D007665
CTD	increases(uptake)			SLC22A2		D007665
CTD	affects(cotreatment)			TNF		D007665
CTD	decreases(expression)			TNF		D007665
CTD	affects(cotreatment)			VCAM1		D007665
CTD	decreases(expression)			VCAM1		D007665
PubChem	Potency	uM	3.162	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	5.012	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	7.943	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	1.995	DRD1	-	GI(Protien) :
ChEMBL	AC50	nM	7943.280	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	3162.280	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	5011.870	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	5011.900	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	3162.300	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	7943.300	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	1995.300	DRD1	-	Target : CHEMBL2056

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