Tan Lab | DSigDB

Gene Set: D4 : TTD - Lansoprazole

Collection

D4 : TTD

Chemical Name

Lansoprazole ( From PubChem : LANSOPRAZOLE )

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
369.361 g/mol	1	4	4.3809	True

Structure

InChI

InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)/t25-/m0/s1

InChIKey

MJIHNNLFOKEZEW-VWLOTQADSA-N

Links

Gene (23 / 57)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			ATP4A		Successful target
TTD	Drug(s)			ATP4A		Successful target
PubChem	Potency-Replicate_1	uM	4.216	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	5.011	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	7.997	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	19.331	AHR	-	GI(Protien) :
PubChem	Potency	uM	25.119	ALOX15	-	GI(Protien) :
PubChem	Potency	uM	35.481	BAZ2B	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	0.100	CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	1.259	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	31.623	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	25.119	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	0.282	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	0.502	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	6.702	EHMT2	-	GI(Protien) :
PubChem	None	uM		GFER	-	GI(Protien) :
PubChem	Potency	uM	15.849	MAPT	-	GI(Protien) :
PubChem	Potency	uM	19.953	MAPT	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Potency	uM	28.184	MAPT	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	8.412	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	10.590	NFE2L2	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	21.690	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	2.818	NPC1	-	GI(Protien) :
PubChem	IC50_Mean	uM	0.434	PHOSPHO1	-	GI(Protien) :
PubChem	Potency	uM	26.680	PLK1	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	None	uM		PRMT1	-	GI(Protien) :
PubChem	Potency	uM	3.981	RAB9A	-	GI(Protien) :
PubChem	Potency	uM	16.834	RGS4	-	GI(Protien) :
PubChem	Potency	uM	10.322	TDP1	-	GI(Protien) :
PubChem	Potency	uM	25.119	VDR	-	GI(Protien) :
PubChem	Potency	uM	44.668	VDR	-	GI(Protien) :
ChEMBL	Potency	nM	25118.900	ALOX15	-	Target : CHEMBL2903
ChEMBL	Potency	nM	35481.300	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	100.000	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	100.000	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	1258.900	CYP2C19	-	Target : CHEMBL3622
ChEMBL	Potency	nM	31622.800	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	25118.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	6701.600	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	281.800	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	14125.400	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	15848.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	28183.800	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	19952.600	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	2818.400	NPC1	-	Target : CHEMBL1293277
ChEMBL	IC50	nM	434.000	PHOSPHO1	-	Target : CHEMBL6113
ChEMBL	Potency	nM	3981.100	RAB9A	-	Target : CHEMBL1293294

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