Tan Lab | DSigDB

Gene Set: D1 - Approved - FINASTERIDE

Collection

D1 : Approved

Chemical Name

FINASTERIDE

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
372.544 g/mol	2	4	4.5342	True

Structure

InChI

InChI=1S/C23H36N2O2/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27)/t14-,15-,16-,17+,18+,22-,23+/m0/s1

InChIKey

DBEPLOCGEIEOCV-WSBQPABSSA-N

Links

Gene (11 / 34)

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Source	Type	Unit	Value	Gene	PMID	Other
PubChem	Ratio Potency (uM)	uM	27.250	AR	-	GI(Protien) :
PubChem	Potency	uM	43.188	AR	-	GI(Protien) :
PubChem	Potency	uM	43.647	AR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	45.354	AR	-	GI(Protien) :
PubChem		uM		CYP1A2		GI(Protien) :
PubChem	IC50	uM	1.000	CYP2C19	-	GI(Protien) :
PubChem		uM		CYP2C19		GI(Protien) :
PubChem	IC50	uM	2.000	CYP2C9	-	GI(Protien) :
PubChem		uM		CYP2C9		GI(Protien) :
PubChem		uM		CYP2D6		GI(Protien) :
PubChem		uM		CYP3A4		GI(Protien) :
PubChem		uM		CYP3A4		GI(Protien) :
PubChem	Ki	uM	11.000	HSD3B1		GI(Protien) :
PubChem	Ratio Potency (uM)	uM	29.847	NFE2L2	-	GI(Protien) :
PubChem	Potency	uM	53.874	NFE2L2	-	GI(Protien) :
PubChem		uM		NR1H4	-	GI(Protien) :
PubChem	IC50	uM	0.060	SRD5A1		GI(Protien) :
PubChem	Ki	uM	0.150	SRD5A1		GI(Protien) :
PubChem	IC50	uM	0.453	SRD5A1		GI(Protien) :
PubChem	IC50	uM	0.540	SRD5A1		GI(Protien) :
PubChem	IC50	uM	0.000	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.002	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.003	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.005	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.030	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.035	SRD5A2		GI(Protien) :
PubChem	IC50	uM	0.060	SRD5A2		GI(Protien) :
PubChem		uM		SRD5A2	-	GI(Protien) :
ChEMBL	Inhibition	-		CYP1A2	-	Target : CHEMBL3356
ChEMBL	Inhibition	-		CYP2C19	-	Target : CHEMBL3622
ChEMBL	Inhibition	-		CYP2C9	-	Target : CHEMBL3397
ChEMBL	Inhibition	-		CYP2D6	-	Target : CHEMBL289
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340
ChEMBL	Inhibition	-		CYP3A4	-	Target : CHEMBL340

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