Tan Lab | DSigDB

Gene Set: D4 : CTD - indatraline

Collection

D4 : CTD

Chemical Name

indatraline ( From PubChem : LU 19005 )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
292.203 g/mol	1	1	5.1804	False(3/4)

Structure

InChI

InChI=1S/C16H15Cl2N/c1-19-16-9-13(11-4-2-3-5-12(11)16)10-6-7-14(17)15(18)8-10/h2-8,13,16,19H,9H2,1H3/t13-,16+/m0/s1

InChIKey

SVFXPTLYMIXFRX-XJKSGUPXSA-N

Links

Gene (25 / 57)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	decreases(reaction)			SLC6A2		C418119
CTD	increases(activity)			SLC6A2		C418119
CTD	increases(reaction)			SLC6A2		C418119
CTD	decreases(reaction)			SLC6A3		C418119
CTD	increases(activity)			SLC6A3		C418119
CTD	increases(reaction)			SLC6A3		C418119
CTD	decreases(reaction)			SLC6A4		C418119
CTD	increases(activity)			SLC6A4		C418119
CTD	increases(reaction)			SLC6A4		C418119
CTD	decreases(reaction)			TAAR1		C418119
CTD	increases(activity)			TAAR1		C418119
CTD	increases(reaction)			TAAR1		C418119
PubChem	Potency	uM	23.100	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	19.953	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	35.481	ATXN2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	10.000	CYP2C19	-	GI(Protien) :
PubChem	None	uM		CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	0.126	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	10.000	CYP3A4	-	GI(Protien) :
PubChem	None	uM		CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	12.589	DRD1	-	GI(Protien) :
PubChem	Potency	uM	18.493	MTOR	-	GI(Protien) :
PubChem	Potency	uM	8.912	NFKB1	-	GI(Protien) :
PubChem	Potency	uM	12.589	THPO	-	GI(Protien) :
PubChem	Potency	uM	12.589	TP53	-	GI(Protien) :
PubChem	Potency	uM	19.953	TP53	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	26.603	AHR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	29.849	AHR	-	GI(Protien) :
PubChem	None	uM		DLD	-	GI(Protien) :
PubChem	None	uM		DRD1	-	GI(Protien) :
PubChem	None	uM		EIF4G1	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	None	uM		NPBWR1	-	GI(Protien) :
PubChem	None	uM		OXTR	-	GI(Protien) :
PubChem	None	uM		SLC6A3	-	GI(Protien) :
PubChem	Potency	uM	11.886	TDP1	-	GI(Protien) :
PubChem	Potency	uM	23.715	TDP1	-	GI(Protien) :
PubChem	None	uM		UBE2N	-	GI(Protien) :
ChEMBL	Potency	nM	23099.900	ATAD5	-	Target : CHEMBL1741209
ChEMBL	AC50	nM	3981.070	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	10000.000	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	10000.000	CYP2C19	-	Target : CHEMBL3622
ChEMBL	AC50	nM	125.890	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	125.900	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	10000.000	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	10000.000	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	12589.300	DRD1	-	Target : CHEMBL2056
ChEMBL	Potency	nM	18492.700	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	8912.500	NFKB1	-	Target : CHEMBL3251
ChEMBL	Potency	nM	12589.300	THPO	-	Target : CHEMBL1293256
ChEMBL	Potency	nM	12589.300	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	19952.600	TP53	-	Target : CHEMBL4096

Download gene sets

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