acompound

General Compound Information
BXGC Id	BXGC0001457
Compound Name	Heptaphylline
Structure
Formula	C18H17NO2
InchiKey	ICYHRFZZQCYWNF-UHFFFAOYSA-N
SMILES	CC(C)=CCC1=C2NC3=CC=CC=C3C2=CC(C=O)=C1O
Inchi	InChI=1S/C18H17NO2/c1-11(2)7-8-14-17-15(9-12(10-20)18(14)21)13-5-3-4-6-16(13)19-17/h3-7,9-10,19,21H,8H2,1-2H3
IUPAC	2-hydroxy-1-(3-methylbut-2-en-1-yl)-9H-carbazole-3-carbaldehyde
Molecular Weight	279.33
Pubchem Id	5318015
Chembl Id	CHEMBL1689799

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

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
P06276	BXGT006430	Cholinesterase	reviewed	-	BCHE	IC50	'>'	100000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00823	Fruits		Fruits
BXGF02861	Clausena excavata	Clausena excavata	Medicinal Plant
BXGF03366	Clausena harmandiana	Clausena harmandiana	Medicinal Plant
BXGF03694	Otholobium pubescens	Otholobium pubescens	Others
BXGF03909	Iris sanguinea	Iris sanguinea	Others
BXGF04412	Rhododendron edgeworthii	Rhododendron edgeworthii	Others
BXGF04443	Populus candicans	Populus candicans	Others
BXGF04645	Clausena heptaphylla	Clausena heptaphylla	Human Edible Plant
BXGF04655	Gutenbergia marginata	Gutenbergia marginata	Others
BXGF04670	Griselinia scandens	Griselinia scandens	Others
BXGF04684	Podocalyx loranthoides	Podocalyx loranthoides	Others
BXGF04703	Trixis grisebachii	Trixis grisebachii	Others
BXGF04721	Helicia erratica	Helicia erratica	Human Edible Plant
BXGF04774	Croton hutchinsonianus	Croton hutchinsonianus	Others
BXGF04790	Cicer cuneatum	Cicer cuneatum	Others
BXGF04803	Bulbine asphodeloides	Bulbine asphodeloides	Medicinal Plant
BXGF04805	Ipomoea carnea	Ipomoea carnea	Medicinal Plant
BXGF04810	Yucca elata	Yucca elata	Medicinal Plant
BXGF04828	Hyptis urticoides	Hyptis urticoides	Others
BXGF04833	Monachosorum maximowiczii	Monachosorum maximowiczii	Others
BXGF04888	Sarcophyton infundibuliforme	Sarcophyton infundibuliforme	Others
BXGF04895	Delphinium speciosum	Delphinium speciosum	Others
BXGF04899	Nardia scalaris	Nardia scalaris	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}