Tan Lab | DSigDB

Gene Set: D4 : TTD - Clomifene

Collection

D4 : TTD

Chemical Name

Clomifene ( From PubChem : CLOMIPHENE )

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
405.96 g/mol	0	2	6.5626	False(3/4)

Structure

InChI

InChI=1S/C26H28ClNO/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23/h5-18H,3-4,19-20H2,1-2H3/b26-25-

InChIKey

Links

Gene (15 / 24)

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Source	Type	Unit	Value	Gene	PMID	Other
TTD	Modulator			ESR1		Successful target
TTD	Drug(s)			ESR1		Successful target
PubChem	Potency-Replicate_1	uM	3.349	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP19A1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	1.452	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	1.693	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	6.189	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	6.682	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	33.489	PPARD	-	GI(Protien) :
PubChem	None	uM		APAF1	-	GI(Protien) :
PubChem	Potency	uM	17.783	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	11.220	GLP1R	-	GI(Protien) :
PubChem	None	uM		KCNQ1	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
PubChem	None	uM		MDM2	-	GI(Protien) :
PubChem	None	uM		MDM4	-	GI(Protien) :
PubChem	AC50_uM	uM	0.529	MLLT3	-	GI(Protien) :
PubChem	None	uM		MLLT3	-	GI(Protien) :
PubChem	Potency	uM	23.109	TDP1	-	GI(Protien) :
PubChem	None	uM		TRHR	-	GI(Protien) :
PubChem	None	uM		UBE2N	-	GI(Protien) :
PubChem	None	uM		UBE2N	-	GI(Protien) :
ChEMBL	Potency	nM	56234.100	KDM4A	-	Target : CHEMBL5896

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