acompound

Showing entry for Acrylic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0004279
Compound Name	Acrylic acid
Structure
Formula	C3H4O2
InchiKey	NIXOWILDQLNWCW-UHFFFAOYSA-N
SMILES	OC(=O)C=C
Inchi	InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)
IUPAC	prop-2-enoic acid
Molecular Weight	72.06
Pubchem Id	6581
Chembl Id	CHEMBL1213529

Targets of Information Source

DrugBank

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
P0AD63	BXGT007276	Beta-lactamase SHV-1	reviewed	-	bla	experimental	-

PDB

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
P0AD64	BXGT007277	Beta-lactamase SHV-1	reviewed	bla	-	-	-	-	-
Q05769	BXGT012834	Prostaglandin G/H synthase 2	reviewed	Ptgs2	-	-	-	-	-
Q4K4R5	BXGT014832	Glutathione S-transferase-like protein YibF	unreviewed	yibF	-	-	-	-	-
D3P639	BXGT002893	Mandelate racemase/muconate lactonizing enzyme	unreviewed	AZL_d02920	-	-	-	-	-
D0CY07	BXGT002674	Peptidase M24	unreviewed	SL1157_2466	-	-	-	-	-
P35354	BXGT009816	Prostaglandin G/H synthase 2	reviewed	PTGS2	Enzyme	-	-	-	-
A8LRC0	BXGT001708	AMP-dependent synthetase and ligase	unreviewed	Dshi_0825	-	-	-	-	-
D0CY60	BXGT002675	Dimethlysulfonioproprionate lyase DddQ	reviewed	dddQ	-	-	-	-	-
W4KMP1	BXGT022617	Glycosyl hydrolase family 61, 2 protein	unreviewed	GH61B	-	-	-	-	-
N8X9V6	BXGT003876	Uncharacterized protein	unreviewed	F963_02809	-	-	-	-	-
P9WNY5	BXGT012431	Probable 3-hydroxyisobutyrate dehydrogenase	reviewed	mmsB	-	-	-	-	-
P9WHR7	BXGT023682	LexA repressor	reviewed	lexA	-	-	-	-	-
C8CP57	BXGT024375	Beta-lactamase	unreviewed	blaCTX-M-64	-	-	-	-	-
H9L477	BXGT025158	Mono(ADP-ribosyl)transferase SpvB	unreviewed	spvB	-	-	-	-	-

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
P25094	BXGT009014	Peripheral myelin protein 22	reviewed	-	Pmp22	Potency	-	287	nM
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	5623	nM
P02545	BXGT005889	Prelamin-A/C	reviewed	-	LMNA	Potency	'='	35481	nM
P32738	BXGT009662	Choline O-acetyltransferase	reviewed	-	Chat	IC50	'<'	200000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00012	Pineapple	Ananas comosus	Fruits
BXGF00204	Common grape	Vitis vinifera	Fruits
BXGF02847	Podocarpus elongata	Podocarpus elongata	Others
BXGF03092	Codium fragile	Codium fragile	Medicinal Plant
BXGF04680	Eschweilera coriacea	Eschweilera coriacea	Human Edible Plant
BXGF05159	Eucalyptus cladocalyx	Eucalyptus cladocalyx	Medicinal Plant
BXGF05510	Ulva pertusa	Ulva pertusa	Medicinal Plant
BXGF05688	Salvadora persica	Salvadora persica	Medicinal Plant
BXGF06321	Peltodon longipes	Peltodon longipes	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}