Tan Lab | DSigDB

Gene Set: D4 : CTD - Gossypol

Collection

D4 : CTD

Chemical Name

Gossypol ( From PubChem : GOSSYPOL )

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
518.554 g/mol	6	8	6.3822	False(1/4)

Structure

InChI

InChI=1S/C30H30O8/c1-11(2)19-15-7-13(5)21(27(35)23(15)17(9-31)25(33)29(19)37)22-14(6)8-16-20(12(3)4)30(38)26(34)18(10-32)24(16)28(22)36/h7-12,33-38H,1-6H3

InChIKey

QBKSWRVVCFFDOT-UHFFFAOYSA-N

Links

Gene (68 / 193)

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Source	Type	Unit	Value	Gene	PMID	Other
CTD	increases(expression)			BBC3		D006072
CTD	affects(activity)			BCL2L1		D006072
CTD	affects(binding)			BCL2L1		D006072
CTD	decreases(expression)			BCL2L1		D006072
CTD	increases(expression)			BCL2L11		D006072
CTD	increases(activity)			CASP3		D006072
CTD	increases(cleavage)			CASP3		D006072
CTD	affects(cotreatment)			CASP3		D006072
CTD	increases(activity)			CASP7		D006072
CTD	affects(cotreatment)			CASP7		D006072
CTD	increases(cleavage)			CASP9		D006072
CTD	decreases(expression)			CCL2		D006072
CTD	increases(reaction)			CCL2		D006072
CTD	affects(cotreatment)			CXCL1		D006072
CTD	decreases(expression)			CXCL1		D006072
CTD	affects(cotreatment)			EPHB4		D006072
CTD	decreases(expression)			EPHB4		D006072
CTD	decreases(expression)			FGF2		D006072
CTD	increases(reaction)			FGF2		D006072
CTD	decreases(expression)			FGFR3		D006072
CTD	increases(reaction)			FGFR3		D006072
CTD	decreases(expression)			ID1		D006072
CTD	increases(reaction)			ID1		D006072
CTD	affects(cotreatment)			LAMA5		D006072
CTD	decreases(expression)			LAMA5		D006072
CTD	decreases(expression)			MCL1		D006072
CTD	decreases(expression)			MDK		D006072
CTD	increases(reaction)			MDK		D006072
CTD	affects(cotreatment)			PDGFA		D006072
CTD	decreases(expression)			PDGFA		D006072
CTD	decreases(reaction)			TYMP		D006072
CTD	increases(expression)			TYMP		D006072
PubChem	None	uM		ABCB1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	26.603	AR	-	GI(Protien) :
PubChem	Potency	uM	19.012	ARSA	-	GI(Protien) :
PubChem	Potency	uM	8.196	ATAD5	-	GI(Protien) :
PubChem	Potency	uM	7.080	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	10.000	ATXN2	-	GI(Protien) :
PubChem	Potency	uM	15.849	BAZ2B	-	GI(Protien) :
PubChem	Potency	uM	17.783	BLM	-	GI(Protien) :
PubChem	Potency	uM	28.184	BLM	-	GI(Protien) :
PubChem	Potency	uM	31.623	BLM	-	GI(Protien) :
PubChem	Potency	uM	35.481	BLM	-	GI(Protien) :
PubChem	Potency	uM	25.119	CASP1	-	GI(Protien) :
PubChem	Potency	uM	10.000	CBX1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	21.132	CYP19A1	-	GI(Protien) :
PubChem	None	uM		CYP1A2	-	GI(Protien) :
PubChem	Potency	uM	31.623	CYP3A4	-	GI(Protien) :
PubChem	Potency	uM	22.387	DRD1	-	GI(Protien) :
PubChem	Potency	uM	9.466	EHMT2	-	GI(Protien) :
PubChem	Potency	uM	35.481	EHMT2	-	GI(Protien) :
PubChem	None	uM		EIF4G1	-	GI(Protien) :
PubChem	IC50	uM	2.551	ESR1	-	GI(Protien) :
PubChem	Ratio Potency (uM)	uM	6.740	ESR1	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	9.521	ESR1	-	GI(Protien) :
PubChem	None	uM		ESR1	-	GI(Protien) :
PubChem	None	uM		ESR2	-	GI(Protien) :
PubChem	Potency	uM	2.512	FEN1	-	GI(Protien) :
PubChem	Potency	uM	11.917	FEN1	-	GI(Protien) :
PubChem	Potency	uM	11.917	FEN1	-	GI(Protien) :
PubChem	Potency	uM	8.912	GAA	-	GI(Protien) :
PubChem	Potency	uM	23.691	GALK1	-	GI(Protien) :
PubChem	Potency	uM	8.912	HPGD	-	GI(Protien) :
PubChem	Potency	uM	12.589	HPGD	-	GI(Protien) :
PubChem	Potency	uM	14.125	HPGD	-	GI(Protien) :
PubChem	Potency	uM	35.481	HPGD	-	GI(Protien) :
PubChem	Potency	uM	7.943	KAT2A	-	GI(Protien) :
PubChem	Potency	uM	10.000	KAT2A	-	GI(Protien) :
PubChem	Potency	uM	19.953	KAT2A	-	GI(Protien) :
PubChem	None	uM		MAP4K2	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPK1	-	GI(Protien) :
PubChem	Potency	uM	19.953	MAPT	-	GI(Protien) :
PubChem	Potency	uM	22.387	MAPT	-	GI(Protien) :
PubChem	Potency	uM	22.387	MAPT	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Potency	uM	25.119	MAPT	-	GI(Protien) :
PubChem	Potency	uM	28.184	MAPT	-	GI(Protien) :
PubChem	Potency	uM	31.623	MAPT	-	GI(Protien) :
PubChem	Potency	uM	35.481	MAPT	-	GI(Protien) :
PubChem	None	uM		MAPT	-	GI(Protien) :
PubChem	Absolute IC50	uM	0.860	MCL1	-	GI(Protien) :
PubChem	IC50	uM	1.523	MCL1	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	None	uM		MCL1	-	GI(Protien) :
PubChem	Potency	uM	15.003	MPHOSPH8	-	GI(Protien) :
PubChem	Potency	uM	2.612	MTOR	-	GI(Protien) :
PubChem	Potency	uM	14.689	MTOR	-	GI(Protien) :
PubChem	Potency	uM	1.694	PIN1	-	GI(Protien) :
PubChem	Potency	uM	1.694	PIN1	-	GI(Protien) :
PubChem	Potency	uM	9.528	PIN1	-	GI(Protien) :
PubChem	Potency	uM	0.562	POLB	-	GI(Protien) :
PubChem	Potency	uM	2.512	POLI	-	GI(Protien) :
PubChem	Potency	uM	1.259	POLK	-	GI(Protien) :
PubChem	Potency	uM	1.995	POLK	-	GI(Protien) :
PubChem	Potency	uM	2.818	POLK	-	GI(Protien) :
PubChem	Potency	uM	10.621	POLK	-	GI(Protien) :
PubChem	Potency	uM	12.589	POLK	-	GI(Protien) :
PubChem	Potency-Replicate_1	uM	18.832	PPARD	-	GI(Protien) :
PubChem	None	uM		PTGER2	-	GI(Protien) :
PubChem	Potency	uM	4.224	RGS4	-	GI(Protien) :
PubChem	None	uM		S1PR4	-	GI(Protien) :
PubChem	None	uM		SLC12A5	-	GI(Protien) :
PubChem	Potency	uM	1.122	SMAD3	-	GI(Protien) :
PubChem	None	uM		STK33	-	GI(Protien) :
PubChem	Potency	uM	0.562	TDP1	-	GI(Protien) :
PubChem	Potency	uM	0.794	TDP1	-	GI(Protien) :
PubChem	Potency	uM	5.805	TDP1	-	GI(Protien) :
PubChem	Potency	uM	5.805	TDP1	-	GI(Protien) :
PubChem	Potency	uM	6.684	TDP1	-	GI(Protien) :
PubChem	Potency	uM	7.499	TDP1	-	GI(Protien) :
PubChem	Potency	uM	17.783	THRB	-	GI(Protien) :
PubChem	Potency	uM	25.119	THRB	-	GI(Protien) :
PubChem	Potency	uM	31.623	THRB	-	GI(Protien) :
PubChem	Potency	uM	35.481	THRB	-	GI(Protien) :
PubChem	Potency	uM	39.811	THRB	-	GI(Protien) :
PubChem	Potency	uM	19.953	TP53	-	GI(Protien) :
PubChem	Potency	uM	19.953	TP53	-	GI(Protien) :
PubChem	None	uM		TSHR		GI(Protien) :
PubChem	None	uM		TSHR		GI(Protien) :
PubChem	Potency	uM	10.000	USP1	-	GI(Protien) :
PubChem	Potency	uM	22.387	USP1	-	GI(Protien) :
PubChem	Potency	uM	31.623	USP1	-	GI(Protien) :
PubChem	Potency	uM	5.212	USP2	-	GI(Protien) :
PubChem	None	uM		VCP	-	GI(Protien) :
PubChem	None	uM		VCP	-	GI(Protien) :
PubChem	Potency	uM	6.310	VDR	-	GI(Protien) :
PubChem	Potency	uM	8.912	VDR	-	GI(Protien) :
PubChem	Potency	uM	11.220	VDR	-	GI(Protien) :
PubChem	Potency	uM	30.747	YES1		GI(Protien) :
ChEMBL	Potency	nM	10000.000	ALOX15B	-	Target : CHEMBL2457
ChEMBL	Potency	nM	3548.100	ALOX15B	-	Target : CHEMBL2457
ChEMBL	Potency	nM	5011.900	ALOX15B	-	Target : CHEMBL2457
ChEMBL	Potency	nM	8196.100	ATAD5	-	Target : CHEMBL1741209
ChEMBL	Potency	nM	15848.900	BAZ2B	-	Target : CHEMBL1741220
ChEMBL	Activity	-		BCL2L1	-	Target : CHEMBL4625
ChEMBL	Potency	nM	28183.800	BLM	-	Target : CHEMBL1293237
ChEMBL	Potency	nM	17782.800	BLM	-	Target : CHEMBL1293237
ChEMBL	Potency	nM	31622.800	BLM	-	Target : CHEMBL1293237
ChEMBL	Potency	nM	35481.300	BLM	-	Target : CHEMBL1293237
ChEMBL	Potency	nM	25118.900	CASP1	-	Target : CHEMBL4801
ChEMBL	Potency	nM	25118.900	CASP1	-	Target : CHEMBL4801
ChEMBL	Potency	nM	12589.300	CASP7	-	Target : CHEMBL3468
ChEMBL	Potency	nM	10000.000	CBX1	-	Target : CHEMBL1741193
ChEMBL	Potency	nM	31622.800	CYP3A4	-	Target : CHEMBL340
ChEMBL	Potency	nM	22387.200	DRD1	-	Target : CHEMBL2056
ChEMBL	Potency	nM	35481.300	EHMT2	-	Target : CHEMBL6032
ChEMBL	Potency	nM	9466.200	EHMT2	-	Target : CHEMBL6032
ChEMBL	IC50	nM	2551.340	ESR1	-	Target : CHEMBL206
ChEMBL	Potency	nM	11917.300	FEN1	-	Target : CHEMBL5027
ChEMBL	Potency	nM	8912.500	GAA	-	Target : CHEMBL2608
ChEMBL	Potency	nM	23690.600	GALK1	-	Target : CHEMBL1293257
ChEMBL	Potency	nM	35481.300	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	12589.300	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	14125.400	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	8912.500	HPGD	-	Target : CHEMBL1293255
ChEMBL	Potency	nM	5011.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	5011.900	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	7943.300	HSD17B10	-	Target : CHEMBL4159
ChEMBL	Potency	nM	19952.600	KAT2A	-	Target : CHEMBL5501
ChEMBL	Potency	nM	7943.300	KAT2A	-	Target : CHEMBL5501
ChEMBL	Potency	nM	10000.000	KAT2A	-	Target : CHEMBL5501
ChEMBL	Potency	nM	7943.300	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	3548.100	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	6309.600	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	7079.500	KDM4E	-	Target : CHEMBL1293226
ChEMBL	Potency	nM	25118.900	MAPK1	-	Target : CHEMBL4040
ChEMBL	Potency	nM	22387.200	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	19952.600	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	28183.800	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	25118.900	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	31622.800	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	35481.300	MAPT	-	Target : CHEMBL1293224
ChEMBL	Potency	nM	22387.200	MAPT	-	Target : CHEMBL1293224
ChEMBL	IC50	nM	1523.100	MCL1	-	Target : CHEMBL4361
ChEMBL	Potency	nM	15003.000	MPHOSPH8	-	Target : CHEMBL1741210
ChEMBL	Potency	nM	2612.200	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	14689.200	MTOR	-	Target : CHEMBL2842
ChEMBL	Potency	nM	9528.300	PIN1	-	Target : CHEMBL2288
ChEMBL	Potency	nM	562.300	POLB	-	Target : CHEMBL2392
ChEMBL	Potency	nM	5011.900	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	22387.200	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	12589.300	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	14125.400	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	3162.300	RECQL	-	Target : CHEMBL1293236
ChEMBL	Potency	nM	31622.800	THRB	-	Target : CHEMBL1947
ChEMBL	Potency	nM	35481.300	THRB	-	Target : CHEMBL1947
ChEMBL	Potency	nM	39810.700	THRB	-	Target : CHEMBL1947
ChEMBL	Potency	nM	17782.800	THRB	-	Target : CHEMBL1947
ChEMBL	Potency	nM	25118.900	THRB	-	Target : CHEMBL1947
ChEMBL	Potency	nM	19952.600	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	19952.600	TP53	-	Target : CHEMBL4096
ChEMBL	Potency	nM	5211.900	USP2	-	Target : CHEMBL1293227

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