acompound

Showing entry for 1H-Indole-3-propanoic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0000565
Compound Name	1H-Indole-3-propanoic acid
Structure
Formula	C11H11NO2
InchiKey	GOLXRNDWAUTYKT-UHFFFAOYSA-N
SMILES	OC(=O)CCC1=CNC2=CC=CC=C12
Inchi	InChI=1S/C11H11NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6H2,(H,13,14)
IUPAC	3-(1H-indol-3-yl)propanoic acid
Molecular Weight	189.21
Pubchem Id	3744
Chembl Id	CHEMBL207225

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
P00509	BXGT005562	Aspartate aminotransferase	reviewed	-	aspC	experimental	-
P95468	BXGT012154	Aromatic-amino-acid aminotransferase	reviewed	-	tyrB	experimental	-
Q9NZK7	BXGT021276	Group IIE secretory phospholipase A2	reviewed	Enzyme	PLA2G2E	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
P00509	BXGT005562	Aspartate aminotransferase	reviewed	aspC	-	-	-	-	-
P95468	BXGT012154	Aromatic-amino-acid aminotransferase	reviewed	tyrB	-	-	-	2600000	-
P59071	BXGT011259	Basic phospholipase A2 VRV-PL-VIIIa	reviewed		-	-	-	-	-
P12499	BXGT007822	Gag-Pol polyprotein	reviewed	gag-pol	-	-	-	5300	-
P12499	BXGT007822	Gag-Pol polyprotein	reviewed	gag-pol	-	-	-	7200	-
B1MDL6	BXGT001895	Phosphopantetheine adenylyltransferase	reviewed	coaD	-	-	-	-	-
P0A881	BXGT007140	Trp operon repressor	reviewed	trpR	-	-	-	-	-
P9WPA5	BXGT012443	Phosphopantetheine adenylyltransferase	reviewed	coaD	-	-	-	-	-

Binding DB

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	BXGT013667	Kynurenine--oxoglutarate transaminase 1	reviewed	Enzyme	KYAT1	-	140000	-	-

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
Q16773	BXGT013667	Kynurenine--oxoglutarate transaminase 1	reviewed	Enzyme	KYAT1	IC50	'='	140000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00141	Common pea	Pisum sativum	Pulses

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}