Tan Lab | DSigDB

Gene Set: D1 - Approved - IRINOTECAN

Collection

D1 : Approved

Chemical Name

IRINOTECAN

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

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
586.678 g/mol	1	10	3.9669	False(3/4)

Structure

InChI

InChI=1S/C33H38N4O6/c1-3-22-23-16-21(43-32(40)36-14-10-20(11-15-36)35-12-6-5-7-13-35)8-9-27(23)34-29-24(22)18-37-28(29)17-26-25(30(37)38)19-42-31(39)33(26,41)4-2/h8-9,16-17,20,41H,3-7,10-15,18-19H2,1-2H3/t33-/m0/s1

InChIKey

UWKQSNNFCGGAFS-XIFFEERXSA-N

Links

Gene (10 / 17)

⊖ Less

Source	Type	Unit	Value	Gene	PMID	Other
PubChem	IC50	uM	1.827	ACHE	-	GI(Protien) :
PubChem	IC50	uM		ACHE		GI(Protien) :
PubChem	IC50	uM	3.171	ADRA2C	-	GI(Protien) :
PubChem	IC50	uM	1.556	CHRM4	-	GI(Protien) :
PubChem	IC50	uM	6.060	MMP1	-	GI(Protien) :
PubChem	IC50	uM	20.800	SLC22A1		GI(Protien) :
PubChem	IC50	uM	2.700	SLC22A2		GI(Protien) :
PubChem	IC50	uM	2.100	SLC47A1		GI(Protien) :
PubChem	IC50	uM	4.300	SLC47A1		GI(Protien) :
PubChem	IC50	uM	7.900	SLC47A1		GI(Protien) :
PubChem	IC50	uM	7.900	SLC47A2		GI(Protien) :
PubChem	Potency	uM	1.778	TDP1	-	GI(Protien) :
PubChem	Potency	uM	3.162	TDP1	-	GI(Protien) :
PubChem		uM		TOP1		GI(Protien) :
PubChem		uM		TOP1		GI(Protien) :
ChEMBL	Inhibition	-		TOP1	-	Target : CHEMBL1781
ChEMBL	Inhibition	-		TOP1	-	Target : CHEMBL1781

Download gene sets

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