acompound

Showing entry for Wedelolactone

General Compound Information
BXGC Id	BXGC0051995
Compound Name	Wedelolactone
Structure
Formula	C16H10O7
InchiKey	XQDCKJKKMFWXGB-UHFFFAOYSA-N
SMILES	COc1cc(O)c2c(c1)oc(=O)c1c2oc2c1cc(c(c2)O)O
Inchi	InChI=1S/C16H10O7/c1-21-6-2-10(19)14-12(3-6)23-16(20)13-7-4-8(17)9(18)5-11(7)22-15(13)14/h2-5,17-19H,1H3
IUPAC	1,8,9-trihydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
Molecular Weight	314.04
Pubchem Id	5281813
Chembl Id	CHEMBL97453

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

50096619

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT009127	Genome polyprotein	reviewed		-	-	36000	-	-
reviewed	BXGT006941	Arachidonate 5-lipoxygenase	reviewed	Enzyme	ALOX5	-	2500	-	-
reviewed	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed		CBR1	-	3780	-	-
reviewed	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed		CBR1	600	-	-	-
reviewed	BXGT004674	Telomere resolvase ResT	reviewed		resT	-	8670	-	-
reviewed	BXGT004126	Inhibitor of nuclear factor kappa-B kinase subunit alpha	reviewed	Kinase	CHUK	-	>10000	-	-
reviewed	BXGT004110	Inhibitor of nuclear factor kappa-B kinase subunit beta	reviewed	Kinase	IKBKB	-	>10000	-	-

CHEMBL

CHEMBL97453

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
O50979	BXGT004674	Telomere resolvase ResT	reviewed	-	resT	Inhibition	'='	70	%
Q9UBT6	BXGT021664	DNA polymerase kappa	reviewed	-	POLK	Potency	-	751	nM
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	Potency	-	28183	nM
K7GQZ4	BXGT003785	Uncharacterized protein	unreviewed	-	ALOX5	Ratio IC50	'='	40	-
Q9NQU5	BXGT021169	Serine/threonine-protein kinase PAK 6	reviewed	-	PAK6	Thermal melting change	'='	0	degrees C
Q8IU85	BXGT018333	Calcium/calmodulin-dependent protein kinase type 1D	reviewed	Kinase	CAMK1D	Thermal melting change	'='	1	degrees C
Q13555	BXGT013375	Calcium/calmodulin-dependent protein kinase type II subunit gamma	reviewed	Kinase	CAMK2G	Thermal melting change	'='	0	degrees C
P23458	BXGT008868	Tyrosine-protein kinase JAK1	reviewed	Kinase	JAK1	Thermal melting change	'='	2	degrees C
P36507	BXGT009923	Dual specificity mitogen-activated protein kinase kinase 2	reviewed	Kinase	MAP2K2	Thermal melting change	'='	0	degrees C
P52564	BXGT010932	Dual specificity mitogen-activated protein kinase kinase 6	reviewed	Kinase	MAP2K6	Thermal melting change	'='	0	degrees C
O75716	BXGT005147	Serine/threonine-protein kinase 16	reviewed	Kinase	STK16	Thermal melting change	'='	0	degrees C
O00506	BXGT003932	Serine/threonine-protein kinase 25	reviewed	Kinase	STK25	Thermal melting change	'='	2	degrees C
Q7WZI7	BXGT017210	Shiga toxin 1 variant A subunit	unreviewed	-	stx1	Potency	-	32603	nM
Q00536	BXGT012535	Cyclin-dependent kinase 16	reviewed	Kinase	CDK16	Thermal melting change	'='	0	degrees C
Q86Y07	BXGT017631	Serine/threonine-protein kinase VRK2	reviewed	Kinase	VRK2	Thermal melting change	'='	1	degrees C
P54646	BXGT011062	5'-AMP-activated protein kinase catalytic subunit alpha-2	reviewed	Kinase	PRKAA2	Thermal melting change	'='	0	degrees C
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	Activity	'='	5	%
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	Ki	'='	600	nM
O50979	BXGT004674	Telomere resolvase ResT	reviewed	-	resT	IC50	'='	8670	nM
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	-	2238	nM
O50979	BXGT004674	Telomere resolvase ResT	reviewed	-	resT	Inhibition	'='	6	%
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	Tm	'<'	2	degrees C
O75828	BXGT005154	Carbonyl reductase [NADPH] 3	reviewed	-	CBR3	Tm	'<'	2	degrees C
P51450	BXGT010847	Nuclear receptor ROR-gamma	reviewed	-	Rorc	Potency	'='	15848	nM
Q13951	BXGT013407	Core-binding factor subunit beta	reviewed	-	CBFB	Potency	-	35481	nM
Q01196	BXGT012575	Runt-related transcription factor 1	reviewed	Transcription factor	RUNX1	Potency	-	35481	nM
Q9F4F7	BXGT020344	4'-phosphopantetheinyl transferase ffp	reviewed	-	ffp	Potency	'='	10000	nM
Q7WZI7	BXGT017210	Shiga toxin 1 variant A subunit	unreviewed	-	stx1	Potency	'='	7980	nM
Q7WZI6	BXGT017209	Shiga toxin 1 variant B subunit	unreviewed	-	stx1	Potency	'='	7980	nM
P02791	BXGT005965	Ferritin light chain	reviewed	-	FTL	Potency	'='	50118	nM
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	-	1258	nM
Q9UBT6	BXGT021664	DNA polymerase kappa	reviewed	-	POLK	Potency	-	1683	nM
P10828	BXGT007624	Thyroid hormone receptor beta	reviewed	Nuclear receptor	THRB	Potency	'='	39810	nM
O95747	BXGT005393	Serine/threonine-protein kinase OSR1	reviewed	Kinase	OXSR1	Thermal melting change	'='	1	degrees C
P10828	BXGT007624	Thyroid hormone receptor beta	reviewed	Nuclear receptor	THRB	Potency	'='	35481	nM
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	Tm	'='	2	degrees C
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	IC50	'='	3780	nM
P78368	BXGT011840	Casein kinase I isoform gamma-2	reviewed	Kinase	CSNK1G2	Thermal melting change	'='	2	degrees C
P27361	BXGT009176	Mitogen-activated protein kinase 3	reviewed	Kinase	MAPK3	Thermal melting change	'='	0	degrees C
O15111	BXGT004126	Inhibitor of nuclear factor kappa-B kinase subunit alpha	reviewed	Kinase	CHUK	IC50	'>'	10000	nM
Q09013	BXGT013023	Myotonin-protein kinase	reviewed	Kinase	DMPK	Thermal melting change	'='	2	degrees C
Q03164	BXGT012700	Histone-lysine N-methyltransferase 2A	reviewed	-	KMT2A	Potency	'='	5011	nM
O00255	BXGT003903	Menin	reviewed	-	MEN1	Potency	'='	5011	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	'='	707	nM
P02791	BXGT005965	Ferritin light chain	reviewed	-	FTL	Potency	'='	12589	nM
Q9ES14	BXGT020314	Gamma-aminobutyric acid receptor subunit epsilon	reviewed	-	Gabre	IC50	'='	2000	nM
Q91ZM7	BXGT019327	GABA theta subunit	unreviewed	-	Gabrq	IC50	'='	2000	nM
P63138	BXGT011502	Gamma-aminobutyric acid receptor subunit beta-2	reviewed	-	Gabrb2	IC50	'='	2000	nM
P63079	BXGT011491	Gamma-aminobutyric acid receptor subunit beta-3	reviewed	-	Gabrb3	IC50	'='	2000	nM
P62813	BXGT011460	Gamma-aminobutyric acid receptor subunit alpha-1	reviewed	-	Gabra1	IC50	'='	2000	nM
P30191	BXGT009410	Gamma-aminobutyric acid receptor subunit alpha-6	reviewed	-	Gabra6	IC50	'='	2000	nM
P28473	BXGT009261	Gamma-aminobutyric acid receptor subunit gamma-3	reviewed	-	Gabrg3	IC50	'='	2000	nM
P28471	BXGT009259	Gamma-aminobutyric acid receptor subunit alpha-4	reviewed	-	Gabra4	IC50	'='	2000	nM
P23576	BXGT008885	Gamma-aminobutyric acid receptor subunit alpha-2	reviewed	-	Gabra2	IC50	'='	2000	nM
P23574	BXGT008884	Gamma-aminobutyric acid receptor subunit gamma-1	reviewed	-	Gabrg1	IC50	'='	2000	nM
P20236	BXGT008551	Gamma-aminobutyric acid receptor subunit alpha-3	reviewed	-	Gabra3	IC50	'='	2000	nM
P19969	BXGT008536	Gamma-aminobutyric acid receptor subunit alpha-5	reviewed	-	Gabra5	IC50	'='	2000	nM
P18508	BXGT008412	Gamma-aminobutyric acid receptor subunit gamma-2	reviewed	-	Gabrg2	IC50	'='	2000	nM
P18506	BXGT008410	Gamma-aminobutyric acid receptor subunit delta	reviewed	-	Gabrd	IC50	'='	2000	nM
P15431	BXGT008122	Gamma-aminobutyric acid receptor subunit beta-1	reviewed	-	Gabrb1	IC50	'='	2000	nM
O09028	BXGT004049	Gamma-aminobutyric acid receptor subunit pi	reviewed	-	Gabrp	IC50	'='	2000	nM
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	'='	2511	nM
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	'='	11220	nM
Q7WZI7	BXGT017210	Shiga toxin 1 variant A subunit	unreviewed	-	stx1	Potency	-	36581	nM
P51450	BXGT010847	Nuclear receptor ROR-gamma	reviewed	-	Rorc	Potency	'='	12589	nM
P09917	BXGT006941	Arachidonate 5-lipoxygenase	reviewed	Enzyme	ALOX5	IC50	'='	2500	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	'='	1000	nM
P11473	BXGT007709	Vitamin D3 receptor	reviewed	Nuclear receptor	VDR	Potency	-	39810	nM
Q05397	BXGT012815	Focal adhesion kinase 1	reviewed	Kinase	PTK2	Inhibition	-	-	-
P11021	BXGT007644	Endoplasmic reticulum chaperone BiP	reviewed	-	HSPA5	Potency	-	1995	nM
P49759	BXGT010734	Dual specificity protein kinase CLK1	reviewed	Kinase	CLK1	Thermal melting change	'='	2	degrees C
O15530	BXGT004177	3-phosphoinositide-dependent protein kinase 1	reviewed	Kinase	PDPK1	Thermal melting change	'='	0	degrees C
P28482	BXGT009263	Mitogen-activated protein kinase 1	reviewed	Kinase	MAPK1	Inhibition	-	-	-
P27361	BXGT009176	Mitogen-activated protein kinase 3	reviewed	Kinase	MAPK3	Inhibition	-	-	-
P16152	BXGT008201	Carbonyl reductase [NADPH] 1	reviewed	-	CBR1	Tm	'='	5	degrees C
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	'='	4466	nM
P11021	BXGT007644	Endoplasmic reticulum chaperone BiP	reviewed	-	HSPA5	Potency	-	50118	nM
Q13951	BXGT013407	Core-binding factor subunit beta	reviewed	-	CBFB	Potency	-	31622	nM
Q01196	BXGT012575	Runt-related transcription factor 1	reviewed	Transcription factor	RUNX1	Potency	-	31622	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	11	%
P10828	BXGT007624	Thyroid hormone receptor beta	reviewed	Nuclear receptor	THRB	Potency	'='	50118	nM
P46063	BXGT010501	ATP-dependent DNA helicase Q1	reviewed	Enzyme	RECQL	Potency	'='	14125	nM
O97447	BXGT005436	Putative fructose-1,6-bisphosphate aldolase	unreviewed	-	ald	Potency	'='	19905	nM
O96013	BXGT005414	Serine/threonine-protein kinase PAK 4	reviewed	Kinase	PAK4	Thermal melting change	'='	1	degrees C
Q9P286	BXGT021299	Serine/threonine-protein kinase PAK 5	reviewed	Kinase	PAK5	Thermal melting change	'='	0	degrees C
P54132	BXGT011032	Bloom syndrome protein	reviewed	-	BLM	Potency	'='	12589	nM
Q9P1W9	BXGT021296	Serine/threonine-protein kinase pim-2	reviewed	Kinase	PIM2	Thermal melting change	'='	2	degrees C
Q13951	BXGT013407	Core-binding factor subunit beta	reviewed	-	CBFB	Potency	-	3162	nM
Q01196	BXGT012575	Runt-related transcription factor 1	reviewed	Transcription factor	RUNX1	Potency	-	3162	nM
O94804	BXGT005334	Serine/threonine-protein kinase 10	reviewed	Kinase	STK10	Thermal melting change	'='	1	degrees C
Q03164	BXGT012700	Histone-lysine N-methyltransferase 2A	reviewed	-	KMT2A	Potency	'='	12589	nM
O00255	BXGT003903	Menin	reviewed	-	MEN1	Potency	'='	12589	nM
P49760	BXGT010735	Dual specificity protein kinase CLK2	reviewed	Kinase	CLK2	Thermal melting change	'='	1	degrees C
Q96NX5	BXGT019702	Calcium/calmodulin-dependent protein kinase type 1G	reviewed	Kinase	CAMK1G	Thermal melting change	'='	0	degrees C
Q00532	BXGT012532	Cyclin-dependent kinase-like 1	reviewed	Kinase	CDKL1	Thermal melting change	'='	0	degrees C
Q16659	BXGT013652	Mitogen-activated protein kinase 6	reviewed	Kinase	MAPK6	Thermal melting change	'='	1	degrees C
Q9P289	BXGT021300	Serine/threonine-protein kinase 26	reviewed	Kinase	STK26	Thermal melting change	'='	1	degrees C
Q9HC98	BXGT020528	Serine/threonine-protein kinase Nek6	reviewed	Kinase	NEK6	Thermal melting change	'='	0	degrees C
Q00534	BXGT012533	Cyclin-dependent kinase 6	reviewed	Kinase	CDK6	Thermal melting change	'='	0	degrees C
Q16566	BXGT013639	Calcium/calmodulin-dependent protein kinase type IV	reviewed	Kinase	CAMK4	Thermal melting change	'='	0	degrees C
Q9Y6M4	BXGT022335	Casein kinase I isoform gamma-3	reviewed	Kinase	CSNK1G3	Thermal melting change	'='	1	degrees C
Q9F4F7	BXGT020344	4'-phosphopantetheinyl transferase ffp	reviewed	-	ffp	Potency	'='	7079	nM
P54132	BXGT011032	Bloom syndrome protein	reviewed	-	BLM	Potency	'='	17782	nM
O96017	BXGT005415	Serine/threonine-protein kinase Chk2	reviewed	Kinase	CHEK2	Thermal melting change	'='	1	degrees C
O43293	BXGT004584	Death-associated protein kinase 3	reviewed	Kinase	DAPK3	Thermal melting change	'='	0	degrees C
P11309	BXGT007685	Serine/threonine-protein kinase pim-1	reviewed	Kinase	PIM1	Thermal melting change	'='	3	degrees C
Q96KB5	BXGT019685	Lymphokine-activated killer T-cell-originated protein kinase	reviewed	Kinase	PBK	Thermal melting change	'='	0	degrees C
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	1778	nM
Q13554	BXGT013374	Calcium/calmodulin-dependent protein kinase type II subunit beta	reviewed	Kinase	CAMK2B	Thermal melting change	'='	0	degrees C
P49841	BXGT010750	Glycogen synthase kinase-3 beta	reviewed	Kinase	GSK3B	Thermal melting change	'='	0	degrees C
Q15759	BXGT013595	Mitogen-activated protein kinase 11	reviewed	Kinase	MAPK11	Thermal melting change	'='	1	degrees C
Q9UKE5	BXGT021741	TRAF2 and NCK-interacting protein kinase	reviewed	Kinase	TNIK	Thermal melting change	'='	1	degrees C
Q9UQM7	BXGT021814	Calcium/calmodulin-dependent protein kinase type II subunit alpha	reviewed	Kinase	CAMK2A	Thermal melting change	'='	1	degrees C
Q13557	BXGT013376	Calcium/calmodulin-dependent protein kinase type II subunit delta	reviewed	Kinase	CAMK2D	Thermal melting change	'='	0	degrees C
Q9HCP0	BXGT020536	Casein kinase I isoform gamma-1	reviewed	Kinase	CSNK1G1	Thermal melting change	'='	1	degrees C
Q9UEE5	BXGT021671	Serine/threonine-protein kinase 17A	reviewed	Kinase	STK17A	Thermal melting change	'='	3	degrees C
Q99986	BXGT019980	Serine/threonine-protein kinase VRK1	reviewed	Kinase	VRK1	Thermal melting change	'='	0	degrees C
Q9H2G2	BXGT020452	STE20-like serine/threonine-protein kinase	reviewed	Kinase	SLK	Thermal melting change	'='	1	degrees C
O14920	BXGT004110	Inhibitor of nuclear factor kappa-B kinase subunit beta	reviewed	Kinase	IKBKB	IC50	'>'	10000	nM
P49761	BXGT010736	Dual specificity protein kinase CLK3	reviewed	Kinase	CLK3	Thermal melting change	'='	2	degrees C
Q15208	BXGT013550	Serine/threonine-protein kinase 38	reviewed	Kinase	STK38	Thermal melting change	'='	0	degrees C
P25963	BXGT009080	NF-kappa-B inhibitor alpha	reviewed	-	NFKBIA	Inhibition	-	-	-
P53350	BXGT010984	Serine/threonine-protein kinase PLK1	reviewed	Kinase	PLK1	Thermal melting change	'='	1	degrees C
Q13043	BXGT013307	Serine/threonine-protein kinase 4	reviewed	Kinase	STK4	Thermal melting change	'='	2	degrees C
Q8IV63	BXGT018341	Inactive serine/threonine-protein kinase VRK3	reviewed	Kinase	VRK3	Thermal melting change	'='	-1	degrees C
K7GQZ4	BXGT003785	Uncharacterized protein	unreviewed	-	ALOX5	IC50	'='	2500000	nM
Q86V86	BXGT017617	Serine/threonine-protein kinase pim-3	reviewed	-	PIM3	Thermal melting change	'='	5	degrees C
P51812	BXGT010893	Ribosomal protein S6 kinase alpha-3	reviewed	Kinase	RPS6KA3	Thermal melting change	'='	1	degrees C
Q96RR4	BXGT019734	Calcium/calmodulin-dependent protein kinase kinase 2	reviewed	Kinase	CAMKK2	Thermal melting change	'='	2	degrees C
P51955	BXGT010908	Serine/threonine-protein kinase Nek2	reviewed	Kinase	NEK2	Thermal melting change	'='	2	degrees C
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	10000	nM
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	11	%
O00444	BXGT003921	Serine/threonine-protein kinase PLK4	reviewed	Kinase	PLK4	Thermal melting change	'='	2	degrees C
P17612	BXGT008322	cAMP-dependent protein kinase catalytic subunit alpha	reviewed	Kinase	PRKACA	Thermal melting change	'='	2	degrees C
Q9BVS4	BXGT020147	Serine/threonine-protein kinase RIO2	reviewed	Kinase	RIOK2	Thermal melting change	'='	3	degrees C
Q9P289	BXGT021300	Serine/threonine-protein kinase 26	reviewed	Kinase	STK26	Thermal melting change	'='	3	degrees C
P24941	BXGT009002	Cyclin-dependent kinase 2	reviewed	Kinase	CDK2	Thermal melting change	'='	-4	degrees C
Q99683	BXGT019947	Mitogen-activated protein kinase kinase kinase 5	reviewed	Kinase	MAP3K5	Thermal melting change	'='	0	degrees C
P51812	BXGT010893	Ribosomal protein S6 kinase alpha-3	reviewed	Kinase	RPS6KA3	Thermal melting change	'='	1	degrees C

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF03052	Eclipta prostrata	Eclipta prostrata	Medicinal Plant
BXGF03282	Ephedra intermedia	Ephedra intermedia	Medicinal Plant
BXGF04602	Platycladus orientalis	Platycladus orientalis	Medicinal Plant
BXGF04651	Garcinia lucida	Garcinia lucida	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}