Tan Lab | DSigDB

Gene Set: D4 : Boss - targretin-gel

Collection

D4 : Boss

Chemical Name

targretin-gel ( From PubChem : BEXAROTENE )

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
348.478 g/mol	1	2	6.1037	False(3/4)

Structure

InChI

InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)

InChIKey

Links

Gene (15 / 22)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			ABCA1
BOSS	Text Mining			CD4
BOSS	Text Mining			IFNA17
BOSS	Text Mining			PGD
BOSS	Text Mining			SLC25A20
PubChem	Potency	uM	68.050	BLM	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	61.131	CYP19A1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	3.758	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	10.962	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	17.374	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	18.834	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	21.130	HSPB1	-	GI(Protien) :
PubChem	Potency	uM	6.310	KAT2A	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.770	NR3C1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM		PPARG	-	GI(Protien) :
PubChem	Potency	uM	22.387	USP1	-	GI(Protien) :
ChEMBL	Potency	nM	68049.600	BLM	-	Target : CHEMBL1293237
ChEMBL	Potency	nM	6309.600	KAT2A	-	Target : CHEMBL5501
ChEMBL	Activity	-		NR1H3	-	Target : CHEMBL2808
ChEMBL	Activity	-		RXRA	-	Target : CHEMBL2061
ChEMBL	Activity	-		RXRA	-	Target : CHEMBL2061
ChEMBL	Activity	-		RXRA	-	Target : CHEMBL2061

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