acompound

Showing entry for Imidazoleacrylic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0003992
Compound Name	Imidazoleacrylic acid
Structure
Formula	C6H6N2O2
InchiKey	LOIYMIARKYCTBW-OWOJBTEDSA-N
SMILES	OC(=O)\C=C\C1=CNC=N1
Inchi	InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+
IUPAC	(2E)-3-(1H-imidazol-4-yl)prop-2-enoic acid
Molecular Weight	138.12
Pubchem Id	736715
Chembl Id	CHEMBL1236602

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
Q88CZ6	BXGT017706	Urocanate hydratase	reviewed	-	hutU	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
P25080	BXGT009011	Urocanate hydratase	reviewed	hutU	-	-	-	-	-

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
P31648	BXGT009561	Sodium- and chloride-dependent GABA transporter 1	reviewed	-	Slc6a1	Activity	'='	54	%
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	22	nM
P31649	BXGT009562	Sodium- and chloride-dependent GABA transporter 2	reviewed	-	Slc6a13	Activity	'='	66	%
P31650	BXGT009563	Sodium- and chloride-dependent GABA transporter 3	reviewed	-	Slc6a11	Activity	'='	105	%
Q6W5P4	BXGT016588	Neuropeptide S receptor	reviewed	-	NPSR1	Potency	'='	5011	nM
Q96KQ7	BXGT019687	Histone-lysine N-methyltransferase EHMT2	reviewed	Epigenetic regulator	EHMT2	Potency	-	12589	nM
P54132	BXGT011032	Bloom syndrome protein	reviewed	-	BLM	Potency	'='	7	nM
P83916	BXGT012025	Chromobox protein homolog 1	reviewed	Epigenetic regulator	CBX1	Potency	-	19952	nM
O95149	BXGT005350	Snurportin-1	reviewed	-	SNUPN	Potency	-	2310	nM
Q14974	BXGT013516	Importin subunit beta-1	reviewed	Transporter	KPNB1	Potency	-	2310	nM
P62826	BXGT011463	GTP-binding nuclear protein Ran	reviewed	Enzyme modulator	RAN	Potency	-	2310	nM
B2RXH2	BXGT002006	Lysine-specific demethylase 4E	reviewed	-	KDM4E	Potency	'='	10000	nM
P15289	BXGT008102	Arylsulfatase A	reviewed	Enzyme	ARSA	Potency	-	1199	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00148	Almond	Prunus dulcis	Nuts
BXGF00200	Mung bean	Vigna radiata	Pulses
BXGF01848	Pyrus pyraster	Pyrus pyraster	Medicinal Plant
BXGF02094	Astragalus oxyphysus	Astragalus oxyphysus	Others
BXGF02497	Hydrodictyon reticulatum	Hydrodictyon reticulatum	Human Edible Plant
BXGF02801	Senecio candollei	Senecio candollei	Others
BXGF02849	Polyscias scutellaria	Polyscias scutellaria	Medicinal Plant
BXGF02871	Centaurea glastifolia	Centaurea glastifolia	Others
BXGF02902	Grindelia havardii	Grindelia havardii	Others
BXGF02918	Nephelium maingayi	Nephelium maingayi	Human Edible Plant
BXGF02934	Galanthus nivalis	Galanthus nivalis	Medicinal Plant
BXGF02954	Euphorbia armena	Euphorbia armena	Others
BXGF06109	Cuscuta reflexa	Cuscuta reflexa	Medicinal Plant
BXGF06113	Plantago depressa	Plantago depressa	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}