Tan Lab | DSigDB

Gene Set: D4 : TTD - Leukotriene antagonist

Collection

D4 : TTD

Chemical Name

Leukotriene antagonist ( From PubChem : PYRILAMINE )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
285.384 g/mol	0	4	2.6584	True

Structure

InChI

InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3

InChIKey

Links

Gene (9 / 25)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			ALOX5		Successful target
TTD	Drug(s)			ALOX5		Successful target
TTD	Antagonist			HRH1		Successful target
TTD	Antagonist			HRH1		Successful target
TTD	Drug(s)			HRH1		Successful target
PubChem	AR Potency (uM)	uM	70.898	AR	-	GI(Protien) :
PubChem	Potency	uM	0.100	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	0.126	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	0.501	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	12.589	KCNH2		GI(Protien) :
PubChem	Potency	uM	12.589	KCNH2		GI(Protien) :
ChEMBL	Inhibition	-		CYP1A2	-	Target : CHEMBL3356
ChEMBL	Inhibition	-		CYP2C19	-	Target : CHEMBL3622
ChEMBL	Inhibition	-		CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	100.000	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	100.000	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	125.890	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	501.200	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	125.900	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	501.190	CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Activity	-		HRH1	-	Target : CHEMBL231
ChEMBL	Activity	-		HRH1	-	Target : CHEMBL231

Download gene sets