acompound

Showing entry for Heptaminol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0025382
Compound Name	Heptaminol
Structure
Formula	C8H19NO
InchiKey	LREQLEBVOXIEOM-UHFFFAOYSA-N
SMILES	CC(CCCC(O)(C)C)N
Inchi	InChI=1S/C8H19NO/c1-7(9)5-4-6-8(2,3)10/h7,10H,4-6,9H2,1-3H3
IUPAC	6-amino-2-methylheptan-2-ol
Molecular Weight	145.15
Pubchem Id	3590
Chembl Id	CHEMBL2111076

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	BXGT004533	Voltage-dependent L-type calcium channel subunit alpha-1C (Fragment)	reviewed		CACNA1C	-	15300	-	-

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
O35505	BXGT004533	Voltage-dependent L-type calcium channel subunit alpha-1C	reviewed	-	CACNA1C	IC50	'='	15300	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00183	Common thyme	Thymus vulgaris	Herbs and Spices
BXGF01506	Thymus quinquecostatus	Thymus quinquecostatus	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}