Tan Lab | DSigDB

Gene Set: D4 : CTD - navitoclax

Collection

D4 : CTD

Chemical Name

navitoclax ( From PubChem : NAVITOCLAX )

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
974.613 g/mol	2	12	11.3995	False(1/4)

Structure

InChI

InChI=1S/C47H55ClF3N5O6S3/c1-46(2)20-18-42(34-8-12-37(48)13-9-34)36(31-46)32-55-22-24-56(25-23-55)39-14-10-35(11-15-39)45(57)53-65(60,61)41-16-17-43(44(30-41)64(58,59)47(49,50)51)52-38(19-21-54-26-28-62-29-27-54)33-63-40-6-4-3-5-7-40/h3-17,30,38,52H,18-29,31-33H2,1-2H3,(H,53,57)/t38-/m1/s1

InChIKey

JLYAXFNOILIKPP-KXQOOQHDSA-N

Links

Gene (10 / 16)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
CTD	affects(activity)			BAK1		C528561
CTD	affects(cotreatment)			BAK1		C528561
CTD	affects(activity)			BAX		C528561
CTD	affects(cotreatment)			BAX		C528561
CTD	affects(cotreatment)			CASP3		C528561
CTD	increases(activity)			CASP3		C528561
CTD	increases(cleavage)			CASP3		C528561
CTD	increases(cleavage)			CASP9		C528561
CTD	increases(cleavage)			GSN		C528561
PubChem	Potency	uM	39.811	POLI	-	GI(Protien) :
PubChem	Potency	uM	67.016	POLI	-	GI(Protien) :
PubChem	Potency	uM	44.668	POLK	-	GI(Protien) :
PubChem	Potency	uM	0.316	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.447	TDP1	-	GI(Protien) :
PubChem	Potency	uM	30.747	YES1		GI(Protien) :
ChEMBL	Inhibition	-		BCL2	-	Target : CHEMBL4860

Download gene sets

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