acompound

Showing entry for Benzene

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0006391
Compound Name	Benzene
Structure
Formula	C6H6
InchiKey	UHOVQNZJYSORNB-UHFFFAOYSA-N
SMILES	C1=CC=CC=C1
Inchi	InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
IUPAC	benzene
Molecular Weight	78.11
Pubchem Id	241
Chembl Id	CHEMBL277500

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
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	-	5700
P00183	BXGT005482	Camphor 5-monooxygenase	reviewed	camC	-	-	-	-	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	400000	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	-	-
P03069	BXGT006015	General control protein GCN4	reviewed	GCN4	-	-	-	-	-
Q00511	BXGT012529	Uricase	reviewed	uaZ	-	-	-	-	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	1000000	-
A3EYF7	BXGT001152	Beta-transaminase	unreviewed		-	-	-	-	-
P0C6X7	BXGT007440	Replicase polyprotein 1ab	reviewed	rep	-	-	-	-	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	58500	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	-	37200
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	480000	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	175000	-
P00720	BXGT005625	Endolysin	reviewed	E	-	-	-	-	18900
O15648	BXGT004185	ATP-dependent 6-phosphofructokinase	reviewed	pfk	-	-	-	-	-

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	BXGT009621	5-hydroxytryptamine receptor 7	reviewed		Htr7	>10000	-	-	-
reviewed	BXGT006636	Beta-2 adrenergic receptor	reviewed	G-protein coupled receptor	ADRB2	>10000	-	-	-
reviewed	BXGT006636	Beta-2 adrenergic receptor	reviewed	G-protein coupled receptor	ADRB2	490	-	-	-
reviewed	BXGT011367	D(2) dopamine receptor	reviewed		Drd2	>10000	-	-	-
reviewed	BXGT026174	Thromboxane A2 receptor	reviewed	G-protein coupled receptor	TBXA2R	>10000	-	-	-
reviewed	BXGT026174	Thromboxane A2 receptor	reviewed	G-protein coupled receptor	TBXA2R	1.4	-	-	-
reviewed	BXGT008976	Thromboxane-A synthase	reviewed		TBXAS1	2.1	-	-	-
reviewed	BXGT026174	Thromboxane A2 receptor	reviewed	G-protein coupled receptor	TBXA2R	3.1	-	-	-

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
P19793	BXGT008515	Retinoic acid receptor RXR-alpha	reviewed	Nuclear receptor	RXRA	Potency	-	794328	nM
P16473	BXGT008234	Thyrotropin receptor	reviewed	G-protein coupled receptor	TSHR	Potency	'='	7943	nM
P04637	BXGT006243	Cellular tumor antigen p53	reviewed	Transcription factor	TP53	Potency	'='	4	nM
Q9R1A7	BXGT021413	Nuclear receptor subfamily 1 group I member 2	reviewed	-	Nr1i2	Potency	-	79432	nM
P16473	BXGT008234	Thyrotropin receptor	reviewed	G-protein coupled receptor	TSHR	Potency	'='	39810	nM
P00720	BXGT005625	Endolysin	reviewed	-	E	Kd	'='	175000	nM
P00720	BXGT005625	Endolysin	reviewed	-	E	Kd	'='	27000	nM
P00720	BXGT005625	Endolysin	reviewed	-	E	Kd	-	-	-
P00720	BXGT005625	Endolysin	reviewed	-	E	Kd	'='	480000	nM
Q03181	BXGT012701	Peroxisome proliferator-activated receptor delta	reviewed	Nuclear receptor	PPARD	Potency	-	28183	nM
P00720	BXGT005625	Endolysin	reviewed	-	E	Delta Tm	'='	1	degrees C

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00040	Pepper (C. annuum)	Capsicum annuum	Vegetables
BXGF00042	Safflower	Carthamus tinctorius	Herbs and Spices
BXGF00068	Turmeric	Curcuma longa	Herbs and Spices
BXGF00100	Lovage	Levisticum officinale	Herbs and Spices
BXGF00134	Common bean	Phaseolus vulgaris	Pulses
BXGF00150	Guava	Psidium guajava	Fruits
BXGF01460	Dracaena cochinchinensis	Dracaena cochinchinensis	Medicinal Plant
BXGF01721	Humulus lupulus	Humulus lupulus	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}