Tan Lab | DSigDB

Gene Set: D4 : Boss - mdl 107826a

Collection

D4 : Boss

Chemical Name

mdl 107826a ( From PubChem : FLAVOPIRIDOL HYDROCHLORIDE )

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
438.301 g/mol	4	6	4.0445	True

Structure

InChI

InChI=1S/C21H20ClNO5.ClH/c1-23-7-6-12(17(27)10-23)19-14(24)8-15(25)20-16(26)9-18(28-21(19)20)11-4-2-3-5-13(11)22;/h2-5,8-9,12,17,24-25,27H,6-7,10H2,1H3;1H/t12?,17-;/m1./s1

InChIKey

LGMSNQNWOCSPIK-UQICWFIISA-N

Links

Gene (23 / 28)

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Source	Type	Unit	Value	Gene	PMID	Other
BOSS	Text Mining			ABCG2
BOSS	Text Mining			ATP8A2
BOSS	Text Mining			AURKB
BOSS	Text Mining			BCL2
BOSS	Text Mining			CASP3
BOSS	Text Mining			CDK1
BOSS	Text Mining			CDK2
BOSS	Text Mining			CDKL2
BOSS	Text Mining			CDT1
BOSS	Text Mining			CLP1
BOSS	Text Mining			MCL1
BOSS	Text Mining			PCNA
BOSS	Text Mining			TNF
BOSS	Text Mining			TP53
PubChem	Potency-Replicate_1	uM	0.106	AR	-	GI(Protien) :
PubChem	AR Potency (uM)	uM	0.114	AR	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.211	CYP19A1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	0.221	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.756	ESR1	-	GI(Protien) :
PubChem	ER Potency (uM)	uM	1.333	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	1.679	ESR1	-	GI(Protien) :
PubChem	None	uM		NR1H4	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	0.674	NR3C1	-	GI(Protien) :
PubChem	None	uM		PPARD	-	GI(Protien) :
PubChem	None	uM		PPARG	-	GI(Protien) :
PubChem	Potency	uM	0.028	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.094	TDP1	-	GI(Protien) :
PubChem	None	uM		VDR	-	GI(Protien) :

Download gene sets

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