acompound

Showing entry for 2-Acetylthiophene

General Compound Information
BXGC Id	BXGC0005177
Compound Name	2-Acetylthiophene
Structure
Formula	C6H6OS
InchiKey	WYJOVVXUZNRJQY-UHFFFAOYSA-N
SMILES	CC(=O)C1=CC=CS1
Inchi	InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
IUPAC	1-(thiophen-2-yl)ethan-1-one
Molecular Weight	126.18
Pubchem Id	6920
Chembl Id	CHEMBL401911

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

50376211

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	BXGT004563	Polyphenol oxidase 2	reviewed		PPO2	-	150000	-	-

CHEMBL

CHEMBL401911

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
O42713	BXGT004563	Polyphenol oxidase 2	reviewed	-	PPO2	IC50	'='	150000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00033	Kohlrabi	Brassica oleracea var. gongylodes	Vegetables
BXGF01966	Chromolaena odorata	Chromolaena odorata	Medicinal Plant
BXGF03082	Bidens pilosa	Bidens pilosa	Medicinal Plant
BXGF03336	Lepidium graminifolium	Lepidium graminifolium	Medicinal Plant
BXGF03378	Drosera indica	Drosera indica	Medicinal Plant
BXGF03515	Astragalus bisulcatus	Astragalus bisulcatus	Medicinal Plant
BXGF03593	Pinus flexilis	Pinus flexilis	Medicinal Plant
BXGF03598	Brachyglottis bidwillii	Brachyglottis bidwillii	Others
BXGF03621	Galium mollugo	Galium mollugo	Medicinal Plant
BXGF03634	Drummondita hassellii	Drummondita hassellii	Others
BXGF03647	Aconitum napellus	Aconitum napellus	Medicinal Plant
BXGF03667	Ephedra distachya	Ephedra distachya	Medicinal Plant
BXGF03685	Typha latifolia	Typha latifolia	Medicinal Plant
BXGF03700	Achillea nana	Achillea nana	Human Edible Plant
BXGF03723	Senegalia mellifera	Senegalia mellifera	Medicinal Plant
BXGF03736	Psilotum nudum	Psilotum nudum	Medicinal Plant
BXGF03777	Uncaria sterrophylla	Uncaria sterrophylla	Human Edible Plant
BXGF03801	Vicia amoena	Vicia amoena	Medicinal Plant
BXGF03834	Flindersia xanthoxyla	Flindersia xanthoxyla	Others
BXGF03849	Calea lantanoides	Calea lantanoides	Others
BXGF03867	Bothriocline ripensis	Bothriocline ripensis	Others
BXGF03886	Ballota limbata	Ballota limbata	Medicinal Plant
BXGF03890	Boenninghausenia albiflora	Boenninghausenia albiflora	Medicinal Plant
BXGF03895	Cibotium barometz	Cibotium barometz	Medicinal Plant
BXGF03911	Dysosma pleianthum	Dysosma pleianthum	Others
BXGF03917	Coronilla cretica	Coronilla cretica	Others
BXGF03945	Gardenia imperialis	Gardenia imperialis	Others
BXGF03955	Grindelia scorzonerifolia	Grindelia scorzonerifolia	Others
BXGF03975	Lonchocarpus atropurpureus	Lonchocarpus atropurpureus	Others
BXGF03996	Baccharoides lasiopus	Baccharoides lasiopus	Medicinal Plant
BXGF05777	Gomesa radicans	Gomesa radicans	Others
BXGF06215	Elaeodendron alluaudianum	Elaeodendron alluaudianum	Others

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}