Tan Lab | DSigDB

Gene Set: D4 : Boss - eucoprost

Collection

D4 : Boss

Chemical Name

eucoprost ( From PubChem : 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 (15 / 20)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			AKR1B1
BOSS	Text Mining			CYGB
BOSS	Text Mining			GCK
BOSS	Text Mining			INS
BOSS	Text Mining			SLC25A20
BOSS	Text Mining			SLC6A3
BOSS	Text Mining			SRD5A1
PubChem	Ratio Potency (uM)	uM	27.250	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	43.188	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	43.647	AR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	45.354	AR	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	29.847	NFE2L2	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	53.874	NFE2L2	-	GI(Protien) :
PubChem	None	uM		NR1H4	-	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

Download gene sets

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