Tan Lab | DSigDB

Gene Set: D4 : TTD - Tamoxifen

Collection

D4 : TTD

Chemical Name

Tamoxifen ( From PubChem : TAMOXIFEN )

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
371.515 g/mol	0	2	5.9961	False(3/4)

Structure

InChI

InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-

InChIKey

NKANXQFJJICGDU-QPLCGJKRSA-N

Links

Gene (21 / 53)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Antagonist			ESR1		Successful target
TTD	Drug(s)			ESR1		Successful target
PubChem	Potency	uM	22.387	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	39.811	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	35.481	BAZ2B	-	GI(Protien) :
PubChem	Potency	uM	35.481	CBX1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	4.354	CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	7.696	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	Potency	uM	10.000	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	12.589	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	18.888	EHMT2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.876	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	1.147	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	1.548	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	1.876	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	8.688	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	9.748	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	13.170	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	13.685	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	54.941	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	54.954	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	77.429	ESR1	-	GI(Protien) :
PubChem	Potency	uM	1.300	GMNN	-	GI(Protien) :
PubChem	Potency	uM	16.360	IDH1	-	GI(Protien) :
PubChem	None	uM		KCNQ1	-	GI(Protien) :
PubChem	None	uM		MLLT3	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	54.941	PPARD	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	31.623	TP53	-	GI(Protien) :
PubChem	Potency	uM	31.623	TP53	-	GI(Protien) :
PubChem	None	uM		UBE2N	-	GI(Protien) :
ChEMBL	Potency	nM	35481.300	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Potency	nM	35481.300	CBX1	-	Target : CHEMBL1741193
ChEMBL	Inhibition	-		CYP1A2	-	Target : CHEMBL3356
ChEMBL	Inhibition	-		CYP2C9	-	Target : CHEMBL3397
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	12589.300	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	10000.000	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	18887.600	EHMT2	-	Target : CHEMBL6032
ChEMBL	Activity	-		ESR1	-	Target : CHEMBL206
ChEMBL	Activity	-		ESR1	-	Target : CHEMBL206
ChEMBL	Activity	-		ESR1	-	Target : CHEMBL206
ChEMBL	Activity	-		ESR1	-	Target : CHEMBL206
ChEMBL	Activity	-		ESR2	-	Target : CHEMBL242
ChEMBL	Activity	-		ESR2	-	Target : CHEMBL242
ChEMBL	Potency	nM	44668.400	KDM4A	-	Target : CHEMBL5896
ChEMBL	Activity	-		PLD1	-	Target : CHEMBL2536
ChEMBL	Activity	-		PLD2	-	Target : CHEMBL2734
ChEMBL	Activity	-		PLD2	-	Target : CHEMBL2734
ChEMBL	Potency	nM	31622.800	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	31622.800	TP53	-	Target : CHEMBL4096

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