KCF-S cluster No. 761 (11 metabolites)

Corresponding Phytochemical cluster No. 23


Plant Species


Cumulative plant class count

class name count
Magnoliophyta 20
Spermatophyta 4
rosids 1
asterids 1

Cumulative family count

class name count
Magnoliaceae 16
Lauraceae 2
Schisandraceae 2
Cupressaceae 2
Taxaceae 2
Celastraceae 1
Lamiaceae 1

KEGG BRITE br08003 External link 512


Categories (1)

br08003 Category # of metabolite
Neolignans 3

metabolites link (3)

br08003 Category KEGG ID KNApSAcK ID
Neolignans C10651 C00000591
Neolignans C10630 C00002609
Neolignans C10878 C00002622

Metabolite list (11)

KNApSAcK ID name ChEMBL link CTD link # of proteins in
ChEMBL interaction
/ related OMIM
/ related KEGG DISEASE
# of genes in
CTD interaction
/ related diseases
figure
C00000591 External link 512 Magnolol
CHEMBL180920
C005498
21 / 17 / 15 1 / 7
C00002609 External link 512 Hinokiol
/ (+)-Hinokiol
CHEMBL16901
26 / 24 / 20
C00002622 External link 512 Randainol
C00029537 External link 512 4-Methoxyhonokiol
/ 4-O-Methyl honokiol
C00030707 External link 512 Magnaldehyde B
CHEMBL250885
C00030708 External link 512 Magnaldehyde E
CHEMBL251060
C00030709 External link 512 Magnolignan C
/ (-)-Magnolignan C
CHEMBL399697
C00039166 External link 512 erythro-Honokitriol
/ (-)-erythro-Honokitriol
C00039712 External link 512 Magnolignan B
C00040143 External link 512 Randaiol
CHEMBL555924
C00040486 External link 512 threo-Honokitriol
/ (+)-threo-Honokitriol

Human Protein / Gene in interactions

33 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein C00000591 C00002609 1 / 1
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00000591 C00002609 1 / 2
O00255 Menin Unclassified protein C00000591 C00002609 2 / 5
P10253 Lysosomal alpha-glucosidase Hydrolase C00000591 C00002609 1 / 1
Q9GZV3 High affinity choline transporter 1 Choline Na-symporter C00000591 C00002609 1 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00000591 C00002609 4 / 3
P21554 Cannabinoid receptor 1 Cannabinoid receptor C00000591 C00002609 0 / 0
P47870 Gamma-aminobutyric acid receptor subunit beta-2 GABA-A beta C00000591 C00002609 0 / 0
P14867 Gamma-aminobutyric acid receptor subunit alpha-1 GABA-A alpha C00000591 C00002609 1 / 1
P34972 Cannabinoid receptor 2 Cannabinoid receptor C00000591 C00002609 0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor C00000591 C00002609 0 / 0
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein C00000591 C00002609 2 / 0
O75496 Geminin Unclassified protein C00000591 C00002609 0 / 0
Q9Y2T6 G-protein coupled receptor 55 Lysophosphatidylinositol receptor C00000591 C00002609 0 / 0
P39748 Flap endonuclease 1 Enzyme C00002609 0 / 0
P17405 Sphingomyelin phosphodiesterase Enzyme C00002609 2 / 2
P00352 Retinal dehydrogenase 1 Enzyme C00000591 0 / 0
O15296 Arachidonate 15-lipoxygenase B Enzyme C00000591 0 / 0
P11021 78 kDa glucose-regulated protein Unclassified protein C00002609 0 / 0
P19793 Retinoic acid receptor RXR-alpha NR2B1 C00002609 0 / 0
P37231 Peroxisome proliferator-activated receptor gamma NR1C3 C00002609 5 / 3
Q13133 Oxysterols receptor LXR-alpha NR1H3 C00002609 0 / 0
P15428 15-hydroxyprostaglandin dehydrogenase [NAD(+)] Enzyme C00000591 2 / 2
Q6W5P4 Neuropeptide S receptor Neuropeptide receptor C00000591 1 / 0
O75164 Lysine-specific demethylase 4A Enzyme C00002609 0 / 0
P27695 DNA-(apurinic or apyrimidinic site) lyase Enzyme C00002609 0 / 0
P37840 Alpha-synuclein Unclassified protein C00002609 4 / 2
Q03181 Peroxisome proliferator-activated receptor delta NR1C2 C00002609 0 / 0
B2RXH2 Lysine-specific demethylase 4E Enzyme C00000591 0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00000591 0 / 0
P06746 DNA polymerase beta Enzyme C00002609 0 / 0
P09917 Arachidonate 5-lipoxygenase Oxidoreductase C00002609 0 / 0
Q13148 TAR DNA-binding protein 43 Unclassified protein C00000591 1 / 1

1 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
5468 PPARG, CIMT1, GLM1, NR1C3, PPARG1, PPARG2, PPARgamma peroxisome proliferator-activated receptor gamma C00000591

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (28)

OMIM preferred title UniProt
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#608584 Asthma-related traits, susceptibility to, 2 Q6W5P4
%606641 Body mass index; bmi P37231
#609338 Carotid intimal medial thickness 1 P37231
#114500 Colorectal cancer; crc P84022
#127750 Dementia, lewy body; dlb P37840
#119900 Digital clubbing, isolated congenital P15428
#611136 Epilepsy, juvenile myoclonic, susceptibility to, 5; ejm5 P14867
#600274 Frontotemporal dementia; ftd P10636
#137800 Glioma susceptibility 1; glm1 P37231
#232300 Glycogen storage disease ii P10253
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#259100 Hypertrophic osteoarthropathy, primary, autosomal recessive, 1; phoar1 P15428
#604367 Lipodystrophy, familial partial, type 3; fpld3 P37231
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#158580 Neuronopathy, distal hereditary motor, type viia; hmn7a Q9GZV3
#257200 Niemann-pick disease, type a P17405
#607616 Niemann-pick disease, type b P17405
#601665 Obesity P37231
#168601 Parkinson disease 1, autosomal dominant; park1 P37840
#605543 Parkinson disease 4, autosomal dominant; park4 P37840
#168600 Parkinson disease, late-onset; pd P37840
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636

KEGG DISEASE (22)

KEGG name UniProt
H00033 Adrenal carcinoma O00255 (related)
H00034 Carcinoid O00255 (related)
H00045 Malignant islet cell carcinoma O00255 (related)
H00246 Primary hyperparathyroidism O00255 (related)
H01102 Pituitary adenomas O00255 (related)
H00069 Glycogen storage diseases (GSD) P10253 (related)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
Q13148 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (related)
H00808 Idiopathic generalized epilepsies (IGEs) P14867 (related)
H00457 Primary hypertrophic osteoarthropathy (PHO) P15428 (related)
H01246 Isolated congenital nail clubbing (ICNC) P15428 (related)
H00137 Niemann-Pick disease (NPD) typeA and B P17405 (related)
H00424 Defects in the degradation of sphingomyelin P17405 (related)
H00032 Thyroid cancer P37231 (related)
H00409 Type II diabetes mellitus P37231 (related)
H00420 Familial partial lipodystrophy (FPL) P37231 (related)
H00057 Parkinson's disease (PD) P37840 (related)
H00066 Lewy body dementia (LBD) P37840 (related)
H00001 Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) Q03164 (related)
Q03164 (marker)
H00002 Acute lymphoblastic leukemia (ALL) (precursor T lymphoblastic leukemia) Q03164 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)

Diseases related to CTD interactions

7 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D002545 Brain Ischemia C00000591
D056486 Drug-Induced Liver Injury C00000591
D005334 Fever C00000591
D018883 Heat Stroke C00000591
D009203 Myocardial Infarction C00000591
D017180 Tachycardia, Ventricular C00000591
D014693 Ventricular Fibrillation C00000591