acompound

Showing entry for 2,3,4,5-Tetrabromo-6-(3,5-Dibromo-2-Hydroxyphenoxy)Phenol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0017558
Compound Name	2,3,4,5-Tetrabromo-6-(3,5-Dibromo-2-Hydroxyphenoxy)Phenol
Structure
Formula	C12H4Br6O3
InchiKey	OMYZFHYKAPRFFQ-UHFFFAOYSA-N
SMILES	Brc1cc(Oc2c(O)c(Br)c(c(c2Br)Br)Br)c(c(c1)Br)O
Inchi	InChI=1S/C12H4Br6O3/c13-3-1-4(14)10(19)5(2-3)21-12-9(18)7(16)6(15)8(17)11(12)20/h1-2,19-20H
IUPAC	2,3,4,5-tetrabromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol
Molecular Weight	669.53
Pubchem Id	339231
Chembl Id	CHEMBL150098

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

n.a

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

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	BXGT008083	Aldo-keto reductase family 1 member B1	reviewed	Enzyme	AKR1B1	-	6400	-	-
reviewed	BXGT008370	Arachidonate 12-lipoxygenase, 12S-type	reviewed	Enzyme	ALOX12	-	410	-	-
reviewed	BXGT008184	Arachidonate 15-lipoxygenase	reviewed	Enzyme	ALOX15	-	790	-	-
reviewed	BXGT008184	Arachidonate 15-lipoxygenase	reviewed	Enzyme	ALOX15	-	1300	-	-

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
Q07820	BXGT012942	Induced myeloid leukemia cell differentiation protein Mcl-1	reviewed	Signaling	MCL1	IC50	'>'	10	ug.mL-1
P16050	BXGT008184	Arachidonate 15-lipoxygenase	reviewed	Enzyme	ALOX15	IC50	'='	1300	nM
P49915	BXGT010763	GMP synthase [glutamine-hydrolyzing]	reviewed	Enzyme	GMPS	Inhibition	'='	96	%
P16050	BXGT008184	Arachidonate 15-lipoxygenase	reviewed	Enzyme	ALOX15	IC50	'='	790	nM
P15121	BXGT008083	Aldo-keto reductase family 1 member B1	reviewed	Enzyme	AKR1B1	IC50	'='	6400	nM
P18054	BXGT008370	Arachidonate 12-lipoxygenase, 12S-type	reviewed	Enzyme	ALOX12	IC50	'='	410	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF01117	Juniperus chinensis	Juniperus chinensis	Others
BXGF01590	Viguiera cordifolia	Viguiera cordifolia	Others
BXGF01692	Achillea leptophylla	Achillea leptophylla	Medicinal Plant
BXGF01740	Oxybasis urbica	Oxybasis urbica	Others
BXGF02216	Zieria chevalieri	Zieria chevalieri	Others
BXGF02312	Alibertia macrophylla	Alibertia macrophylla	Others
BXGF02418	Dorstenia barnimiana	Dorstenia barnimiana	Human Edible Plant
BXGF02591	Uvaria mocoli	Uvaria mocoli	Medicinal Plant
BXGF02602	Sedum forsterianum	Sedum forsterianum	Medicinal Plant
BXGF03479	Bombax ceiba	Bombax ceiba	Medicinal Plant
BXGF05352	Dioscorea futschauensis	Dioscorea futschauensis	Medicinal Plant
BXGF05917	Verbascum georgicum	Verbascum georgicum	Others
BXGF06138	Rubia ustulata	Rubia ustulata	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}