Tan Lab | DSigDB

Gene Set: D1 - Approved - ETHYLESTRENOL

Collection

D1 : Approved

Chemical Name

ETHYLESTRENOL

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
288.467 g/mol	1	1	5.0903	False(3/4)

Structure

InChI

InChI=1S/C20H32O/c1-3-20(21)13-11-18-17-9-8-14-6-4-5-7-15(14)16(17)10-12-19(18,20)2/h6,15-18,21H,3-5,7-13H2,1-2H3/t15-,16+,17+,18-,19-,20-/m0/s1

InChIKey

Links

Gene (12 / 23)

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Source	Type	Unit	Value	Gene	PMID	Other
PubChem	IC50	uM	6.504	ACHE	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	2.051	AR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	2.582	AR	-	GI(Protien) :
PubChem	Potency	uM	10.591	AR	-	GI(Protien) :
PubChem	Potency	uM	10.682	AR	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	11.883	AR	-	GI(Protien) :
PubChem		uM		AR		GI(Protien) :
PubChem	IC50	uM	0.292	CHRM2	-	GI(Protien) :
PubChem	IC50	uM	1.291	CYP2C19	-	GI(Protien) :
PubChem	Potency	uM	0.001	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.001	ESR1	-	GI(Protien) :
PubChem	IC50	uM	1.121	ESR1	-	GI(Protien) :
PubChem	Potency	uM		ESR1	-	GI(Protien) :
PubChem	Potency	uM	23.715	GMNN	-	GI(Protien) :
PubChem		uM		NR1H4	-	GI(Protien) :
PubChem	Potency	uM	1.693	NR3C1	-	GI(Protien) :
PubChem	IC50	uM	2.098	SLC6A2	-	GI(Protien) :
PubChem	IC50	uM	0.081	SLC6A4	-	GI(Protien) :
PubChem	Potency	uM	5.309	TDP1	-	GI(Protien) :
PubChem	Potency	uM	7.499	TDP1	-	GI(Protien) :
PubChem	Potency	uM	3.758	TP53	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	6.682	TP53	-	GI(Protien) :
ChEMBL	Potency	nM	23715.000	GMNN	-	Target : CHEMBL1293278

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