acompound

Showing entry for 2-Benzylbenzoic acid

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0034063
Compound Name	2-Benzylbenzoic acid
Structure
Formula	C14H12O2
InchiKey	FESDHLLVLYZNFY-UHFFFAOYSA-N
SMILES	OC(=O)c1ccccc1Cc1ccccc1
Inchi	InChI=1S/C14H12O2/c15-14(16)13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16)
IUPAC	2-benzylbenzoic acid
Molecular Weight	212.08
Pubchem Id	11924
Chembl Id	CHEMBL1879588

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

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
P9WFX5	BXGT012254	Anthranilate phosphoribosyltransferase	reviewed	trpD	-	-	-	-	-

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
Q9K2N0	BXGT020869	Beta-lactamase class B VIM-2	unreviewed	-	vim-2	IC50	'>'	1000000	nM
Q9UBT6	BXGT021664	DNA polymerase kappa	reviewed	-	POLK	Potency	-	26679	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01304	Conyza canadensis	Conyza canadensis	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}