acompound

Showing entry for (E)-3-(4-Hydroxyphenyl)-2-propenal

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0011724
Compound Name	(E)-3-(4-Hydroxyphenyl)-2-propenal
Structure
Formula	C9H8O2
InchiKey	CJXMVKYNVIGQBS-OWOJBTEDSA-N
SMILES	OC1=CC=C(\C=C\C=O)C=C1
Inchi	InChI=1S/C9H8O2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-7,11H/b2-1+
IUPAC	(2E)-3-(4-hydroxyphenyl)prop-2-enal
Molecular Weight	148.16
Pubchem Id	641301
Chembl Id	CHEMBL431836

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

n.a

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

CHEMBL

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
Q9Y6L6	BXGT022334	Solute carrier organic anion transporter family member 1B1	reviewed	Transporter	SLCO1B1	Inhibition	'='	139	%
P10636	BXGT007596	Microtubule-associated protein tau	reviewed	-	MAPT	Potency	'='	7079	nM
Q9NPD5	BXGT021151	Solute carrier organic anion transporter family member 1B3	reviewed	Transporter	SLCO1B3	Inhibition	'='	70	%
P00352	BXGT005510	Retinal dehydrogenase 1	reviewed	Enzyme	ALDH1A1	Potency	'='	3548	nM
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	28183	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	16360	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	29092	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00818	Herbs and Spices		Herbs and Spices
BXGF00823	Fruits		Fruits
BXGF02403	Eucalyptus radiata	Eucalyptus radiata	Human Edible Plant
BXGF02479	Torreya nuncifera	Torreya nuncifera	Others
BXGF02574	Torreya grandis	Torreya grandis	Medicinal Plant
BXGF03312	Ajania fruticulosa	Ajania fruticulosa	Medicinal Plant
BXGF04785	Ilex taubertiana	Ilex taubertiana	Others
BXGF05383	Alpinia galanga	Alpinia galanga	Medicinal Plant
BXGF05626	Annona glabra	Annona glabra	Medicinal Plant
BXGF05809	Sonchus oleraceus	Sonchus oleraceus	Medicinal Plant
BXGF06052	Astragalus curvicarpus	Astragalus curvicarpus	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}