Tan Lab | DSigDB

Gene Set: D4 : TTD - KAEMPFEROL

Collection

D4 : TTD

Chemical Name

KAEMPFEROL ( From PubChem : KAEMPFEROL )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
286.236 g/mol	4	6	2.2824	True

Structure

InChI

InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H

InChIKey

IYRMWMYZSQPJKC-UHFFFAOYSA-N

Links

Gene (34 / 61)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Inhibitor			AKR1B1		Successful target
TTD	Inhibitor			ALOX15		Research target
TTD	Inhibitor			ALOX15B		Research target
TTD	Inhibitor			ALOX5		Research target
TTD	Inhibitor			AR		Clinical trial target
TTD	Inhibitor			CYP1B1		Research target
TTD	Inhibitor			GLO1		Research target
TTD	Inhibitor			HSD17B1		Research target
PubChem	None	uM		ADAM10	-	GI(Protien) :
PubChem	None	uM		ADAM17	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	30.513	AHR	-	GI(Protien) :
PubChem	AhR Potency (uM)	uM	44.553	AHR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	26.408	AR	-	GI(Protien) :
PubChem	None	uM		CHRM1	-	GI(Protien) :
PubChem	IC50	uM	9.933	CTDSP1	-	GI(Protien) :
PubChem	None	uM		CTDSP1	-	GI(Protien) :
PubChem	None	uM		CTDSP1	-	GI(Protien) :
PubChem	None	uM		CTDSP1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP2C9	-	GI(Protien) :
PubChem	Potency	uM	10.000	CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP2D6	-	GI(Protien) :
PubChem	None	uM		CYP2D6	-	GI(Protien) :
PubChem	Potency	uM	15.849	CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	7.943	ESR1	-	GI(Protien) :
PubChem	Potency	uM	8.912	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	18.431	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.797	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	21.797	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	24.238	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.264	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	27.441	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	33.040	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	33.246	ESR1	-	GI(Protien) :
PubChem	EC50_uM	uM	11.590	GSK3B	-	GI(Protien) :
PubChem	Potency	uM	1.585	HIF1A	-	GI(Protien) :
PubChem	Potency	uM	28.184	HPGD	-	GI(Protien) :
PubChem	Potency	uM	12.589	MAPT	-	GI(Protien) :
PubChem	None	uM		MAPT	-	GI(Protien) :
PubChem	Potency	uM	21.690	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	44.668	NR1I2	-	GI(Protien) :
PubChem	None	uM		NR3C1	-	GI(Protien) :
PubChem	None	uM		PAFAH1B3	-	GI(Protien) :
PubChem	None	uM		PIM2	-	GI(Protien) :
PubChem	Potency	uM	25.119	POLH	-	GI(Protien) :
PubChem	Potency	uM	79.433	POLI	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM		PPARG	-	GI(Protien) :
PubChem	IC50	uM	44.490	RACGAP1	-	GI(Protien) :
PubChem	None	uM		STK16	-	GI(Protien) :
ChEMBL	AC50	nM	79.430	CYP1A2	-	Target : CHEMBL3356
ChEMBL	Potency	nM	15848.900	CYP2C9	-	Target : CHEMBL3397
ChEMBL	Potency	nM	10000.000	CYP2D6	-	Target : CHEMBL289
ChEMBL	AC50	nM	10000.000	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	15848.900	CYP2D6	-	Target : CHEMBL289
ChEMBL	Potency	nM	15848.900	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	1584.900	HIF1A	-	Target : CHEMBL4261
ChEMBL	Potency	nM	28183.800	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	15848.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	12589.300	MAPT	-	Target : CHEMBL1293224

Download gene sets

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