acompound

Showing entry for Hymecromone

General Compound Information
BXGC Id	BXGC0047169
Compound Name	Hymecromone
Structure
Formula	C10H8O3
InchiKey	HSHNITRMYYLLCV-UHFFFAOYSA-N
SMILES	Oc1ccc2c(c1)oc(=O)cc2C
Inchi	InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3
IUPAC	7-hydroxy-4-methylchromen-2-one
Molecular Weight	176.05
Pubchem Id	5280567
Chembl Id	CHEMBL12208

Targets of Information Source

DrugBank

DB07118

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
A0A0H2Z368	BXGT000344	Arylsulfate sulfotransferase AssT	unreviewed	-	assT	experimental; investigational	-

PDB

4MU

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
Q8FDI4	BXGT018127	Arylsulfate sulfotransferase AssT	reviewed	assT	-	-	-	-	-
P07987	BXGT006709	Exoglucanase 2	reviewed	cbh2	-	-	-	-	-
D6D1V7	BXGT002974	Glycosyl hydrolase family 71	unreviewed	BXY_34140	-	-	-	-	-
Q60675	BXGT015994	Laminin subunit alpha-2	reviewed	Lama2	-	-	-	-	-
Q06528	BXGT012881	Carminomycin 4-O-methyltransferase DnrK	reviewed	dnrK	-	-	-	-	-

Binding DB

50022178

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	BXGT012285	dTDP-4-dehydrorhamnose 3,5-epimerase	reviewed		rmlC	-	999	-	-
reviewed	BXGT009127	Genome polyprotein	reviewed		-	-	33800	-	-
reviewed	BXGT005689	Carbonic anhydrase 1	reviewed		CA1	4800	-	-	-
reviewed	BXGT005690	Carbonic anhydrase 2	reviewed		CA2	>2.00e+5	-	-	-
reviewed	BXGT013670	Carbonic anhydrase 9	reviewed		CA9	450	-	-	-
reviewed	BXGT004601	Carbonic anhydrase 12	reviewed		CA12	4300	-	-	-
reviewed	BXGT008753	UDP-glucuronosyltransferase 1-1	reviewed		UGT1A1	-	100000	-	-
reviewed	BXGT009172	Amine oxidase [flavin-containing] B	reviewed		MAOB	-	80410	-	-
reviewed	BXGT009956	Testosterone 17-beta-dehydrogenase 3	reviewed		HSD17B3	-	1000	-	-
reviewed	BXGT008083	Aldo-keto reductase family 1 member B1	reviewed	Enzyme	AKR1B1	-	24500	-	-
reviewed	BXGT012549	Sorbitol dehydrogenase	reviewed	Enzyme	SORD	-	153000	-	-
reviewed	BXGT008526	Nuclear factor NF-kappa-B p105 subunit	reviewed	Transcription factor	NFKB1	-	200000	-	-
reviewed	BXGT004601	Carbonic anhydrase 12	reviewed		CA12	8100	-	-	-
reviewed	BXGT005689	Carbonic anhydrase 1	reviewed		CA1	>100000	-	-	-
reviewed	BXGT005690	Carbonic anhydrase 2	reviewed		CA2	>100000	-	-	-
reviewed	BXGT013670	Carbonic anhydrase 9	reviewed		CA9	560	-	-	-
reviewed	BXGT006700	Aldo-keto reductase family 1 member B1	reviewed		Akr1b1	-	62000	-	-
reviewed	BXGT011959	Cholinesterase	reviewed		BCHE	-	>500000	-	-
reviewed	BXGT004559	Acetylcholinesterase	reviewed		ache	-	167000	-	-

CHEMBL

CHEMBL12208

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
P21397	BXGT008644	Amine oxidase [flavin-containing] A	reviewed	-	MAOA	Activity	-	-	-
O89049	BXGT005293	Thioredoxin reductase 1, cytoplasmic	reviewed	-	Txnrd1	Potency	-	56234	nM
Q9HAW9	BXGT020510	UDP-glucuronosyltransferase 1-8	reviewed	-	UGT1A8	Activity	'='	1180	pm/min/mg
P00918	BXGT005690	Carbonic anhydrase 2	reviewed	-	CA2	Ki	'>'	100000	nM
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	AC50	-	-	-
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	19952	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat	'='	0	/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	8	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	4	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	21	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	1	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	38	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	6	%
P10253	BXGT007550	Lysosomal alpha-glucosidase	reviewed	Enzyme	GAA	Potency	'='	25118	nM
O75795	BXGT005152	UDP-glucuronosyltransferase 2B17	reviewed	-	UGT2B17	Activity	'='	0	pm/min/mg
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat/Km	'='	10	/mM/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	13	%
Q9HAW9	BXGT020510	UDP-glucuronosyltransferase 1-8	reviewed	-	UGT1A8	Activity	'='	1234	pm/min/mg
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat/Km	'='	0	/mM/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	41	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	1	%
Q9HAW8	BXGT020509	UDP-glucuronosyltransferase 1-10	reviewed	-	UGT1A10	Activity	'='	26	pm/min/mg
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat/Km	'='	1	/mM/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Km	'='	0	/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	96	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	24	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	2	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	48	%
Q99714	BXGT019954	3-hydroxyacyl-CoA dehydrogenase type-2	reviewed	Enzyme	HSD17B10	Potency	'='	10000	nM
P15428	BXGT008121	15-hydroxyprostaglandin dehydrogenase [NAD(+)]	reviewed	-	HPGD	Potency	'='	12589	nM
Q00796	BXGT012549	Sorbitol dehydrogenase	reviewed	Enzyme	SORD	IC50	'='	153000	nM
O60656	BXGT004889	UDP-glucuronosyltransferase 1-9	reviewed	-	UGT1A9	Activity	'='	1500	pm/min/mg
Q9HAW8	BXGT020509	UDP-glucuronosyltransferase 1-10	reviewed	-	UGT1A10	Activity	'='	10	pm/min/mg
P02791	BXGT005965	Ferritin light chain	reviewed	-	FTL	Potency	'='	11220	nM
Q99714	BXGT019954	3-hydroxyacyl-CoA dehydrogenase type-2	reviewed	Enzyme	HSD17B10	Potency	'='	2511	nM
P35503	BXGT009840	UDP-glucuronosyltransferase 1-3	reviewed	-	UGT1A3	Activity	'='	400	pm/min/mg
P36537	BXGT009924	UDP-glucuronosyltransferase 2B10	reviewed	-	UGT2B10	Activity	'='	0	pm/min/mg
P55210	BXGT011110	Caspase-7	reviewed	Enzyme	CASP7	Potency	'='	12589	nM
O95149	BXGT005350	Snurportin-1	reviewed	-	SNUPN	Potency	-	70794	nM
Q14974	BXGT013516	Importin subunit beta-1	reviewed	Transporter	KPNB1	Potency	-	70794	nM
P15121	BXGT008083	Aldo-keto reductase family 1 member B1	reviewed	Enzyme	AKR1B1	IC50	'='	24500	nM
P27338	BXGT009172	Amine oxidase [flavin-containing] B	reviewed	-	MAOB	IC50	'='	80410	nM
O43570	BXGT004601	Carbonic anhydrase 12	reviewed	-	CA12	Ki	'='	8100	nM
Q16790	BXGT013670	Carbonic anhydrase 9	reviewed	-	CA9	Ki	'='	560	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	15	nmol/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	13	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	47	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	11	%
P19224	BXGT008468	UDP-glucuronosyltransferase 1-6	reviewed	-	UGT1A6	Activity	'='	46	pm/min/mg
P19224	BXGT008468	UDP-glucuronosyltransferase 1-6	reviewed	-	UGT1A6	Activity	'='	12	pm/min/mg
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	Potency	-	11220	nM
P16662	BXGT008253	UDP-glucuronosyltransferase 2B7	reviewed	-	UGT2B7	Activity	'='	0	pm/min/mg
P02545	BXGT005889	Prelamin-A/C	reviewed	-	LMNA	Potency	'='	4	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	5	nmol/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Km	'='	300000	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	10	%
P19838	BXGT008526	Nuclear factor NF-kappa-B p105 subunit	reviewed	Transcription factor	NFKB1	IC50	'='	200000	nM
P29466	BXGT009349	Caspase-1	reviewed	Enzyme	CASP1	Potency	'='	12589	nM
P22309	BXGT008753	UDP-glucuronosyltransferase 1-1	reviewed	-	UGT1A1	Activity	'='	146	pm/min/mg
P0DTE4	BXGT022286	UDP-glucuronosyltransferase 2A1	reviewed	-	UGT2A1	Activity	'='	680	pm/min/mg
P22309	BXGT008753	UDP-glucuronosyltransferase 1-1	reviewed	-	UGT1A1	IC50	'='	100000	nM
P07943	BXGT006700	Aldo-keto reductase family 1 member B1	reviewed	-	Akr1b1	IC50	'='	62000	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	4	%
P00915	BXGT005689	Carbonic anhydrase 1	reviewed	-	CA1	Ki	'>'	100000	nM
P06280	BXGT006433	Alpha-galactosidase A	reviewed	-	GLA	Potency	'='	28183	nM
P04062	BXGT006140	Lysosomal acid glucosylceramidase	reviewed	-	GBA	Potency	-	14125	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	32642	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	85	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	45	%
P83916	BXGT012025	Chromobox protein homolog 1	reviewed	Epigenetic regulator	CBX1	Potency	-	2511	nM
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	0	%
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	Potency	'='	12589	nM
P11712	BXGT007738	Cytochrome P450 2C9	reviewed	-	CYP2C9	AC50	-	-	-
Q99700	BXGT019949	Ataxin-2	reviewed	Nucleic acid binding	ATXN2	Potency	-	15848	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	IC50	'>'	100000	nM
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	IC50	'>'	100	nM
Q9HAW7	BXGT020508	UDP-glucuronosyltransferase 1-7	reviewed	-	UGT1A7	Activity	'='	220	pm/min/mg
Q9HAW9	BXGT020510	UDP-glucuronosyltransferase 1-8	reviewed	-	UGT1A8	Activity	'='	0	pm/min/mg
P54855	BXGT011088	UDP-glucuronosyltransferase 2B15	reviewed	-	UGT2B15	Activity	'='	170	pm/min/mg
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat	'='	1	/min
P00352	BXGT005510	Retinal dehydrogenase 1	reviewed	Enzyme	ALDH1A1	Potency	'='	15848	nM
P22309	BXGT008753	UDP-glucuronosyltransferase 1-1	reviewed	-	UGT1A1	Activity	'='	800	pm/min/mg
P19224	BXGT008468	UDP-glucuronosyltransferase 1-6	reviewed	-	UGT1A6	Activity	'='	1100	pm/min/mg
Q9HAW8	BXGT020509	UDP-glucuronosyltransferase 1-10	reviewed	-	UGT1A10	Activity	'='	8	pm/min/mg
P22310	BXGT008754	UDP-glucuronosyltransferase 1-4	reviewed	-	UGT1A4	Activity	'='	0	pm/min/mg
P06280	BXGT006433	Alpha-galactosidase A	reviewed	-	GLA	Potency	-	19952	nM
P33261	BXGT009707	Cytochrome P450 2C19	reviewed	-	CYP2C19	AC50	-	-	-
P06133	BXGT006414	UDP-glucuronosyltransferase 2B4	reviewed	-	UGT2B4	Activity	'='	0	pm/min/mg
P16662	BXGT008253	UDP-glucuronosyltransferase 2B7	reviewed	-	UGT2B7	Activity	'='	4	pm/min/mg
O89049	BXGT005293	Thioredoxin reductase 1, cytoplasmic	reviewed	-	Txnrd1	Potency	-	50118	nM
O75496	BXGT005132	Geminin	reviewed	-	GMNN	Potency	-	2909	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	IC50	'='	167000	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	2	nmol/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	51	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Km	'='	140000	nM
P05067	BXGT006306	Amyloid-beta precursor protein	reviewed	Enzyme modulator	APP	Inhibition	'='	21	%
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	20596	nM
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat/Km	'='	43	/mM/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	22	%
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	6	nmol/min
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	IC50	'>'	500000	nM
P37058	BXGT009956	Testosterone 17-beta-dehydrogenase 3	reviewed	-	HSD17B3	IC50	'='	1000	nM
P05177	BXGT006336	Cytochrome P450 1A2	reviewed	Enzyme	CYP1A2	AC50	'='	3981	nM
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	AC50	-	-	-
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	84	nmol/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Kcat	'='	1	/min
Q53685	BXGT015002	Oleandomycin glycosyltransferase	reviewed	-	oleD	Activity	'='	31	%
P19224	BXGT008468	UDP-glucuronosyltransferase 1-6	reviewed	-	UGT1A6	Activity	-	-	-
P54803	BXGT011082	Galactocerebrosidase	reviewed	-	GALC	Potency	-	28183	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF04881	Fallopia multiflora	Fallopia multiflora	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}