KCF-S cluster No. 89 (52 metabolites)

Corresponding Phytochemical cluster No. 4



Metabolite list (52)

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
C00001791 External link 512 Adiantifoline
CHEMBL2002665
C087813
C00001845 External link 512 Dauricine
CHEMBL442717
CHEMBL1721004
CHEMBL1995008
C035934
2 / 2 / 2 1 / 2
C00001858 External link 512 Fetidine
C00001920 External link 512 Thalicarpine
/ (+)-Thalicarpine
CHEMBL507100
C073328
C00025262 External link 512 Berbamunine
/ (+)-Berbamunine
CHEMBL1187468
C00025606 External link 512 Daurisoline
/ (-)-Daurisoline
/ (R,R)-Daurisoline
CHEMBL2216904
C023968
1 / 2 / 2
C00025611 External link 512 Grisabine
/ (-)-Grisabine
/ 1-Epicuspidaline
CHEMBL1186148
C00025616 External link 512 Dauriciline
/ Guattegaumerine
/ 1'betaH-Berbamunine
/ N,N'-Dimethyllindoldhamine
/ (-)-N,N'-Dimethyllindoldhamine
CHEMBL1187468
C052054
C00025836 External link 512 Dauricinoline
C00025837 External link 512 Dauricoline
C00025839 External link 512 Daurinoline
C00025880 External link 512 Magnolin
/ Grisabutine
CHEMBL1187468
C00025930 External link 512 Lindoldhamine
/ (+)-Lindoldhamine
CHEMBL1375576
9 / 8 / 11
C00026053 External link 512 Sutchueneneonine
/ (+)-Sutchueneneonine
C00027491 External link 512 Thalibealine
/ (-)-Thalibealine
C00027493 External link 512 Thalmelatidine
C087814
C00027501 External link 512 Vateamine 2'beta-N-oxide
C00027522 External link 512 Berbamunine
/ (+)-Berbamunine
CHEMBL1187468
C00027552 External link 512 Isopyruthaline
/ (+)-Isopyruthaline
C00027553 External link 512 Isopythaline
C00027562 External link 512 Malekulatine
/ (+)-Malekulatine
CHEMBL504018
C00027612 External link 512 (-)-Temuconine
C00028041 External link 512 (+)-O-Methylchenabinol
/ Chenabinol methyl ether
/ (+)-Chenabinol methyl ether
C00028061 External link 512 Cissampentine
C00028131 External link 512 Dauricine
CHEMBL442717
CHEMBL1721004
CHEMBL1995008
C035934
2 / 2 / 2 1 / 2
C00028257 External link 512 Espinine
C00028341 External link 512 Herveline A
C00028342 External link 512 Herveline B
C00028343 External link 512 Herveline C
C00028473 External link 512 Liensinine
C080095
C00028677 External link 512 Neosutchuenenine
C00028790 External link 512 Pakistanine
/ (+)-Pakistanine
C008754
C00029065 External link 512 Sutchuenenine
C00029101 External link 512 Thalictrogamine
C00029103 External link 512 Thalifaberidine
CHEMBL446572
C091306
C00029104 External link 512 Thalifaramine
C00029105 External link 512 Thalifarazine
C00029106 External link 512 Thalifaronine
C00029111 External link 512 Thalipine
C00029113 External link 512 Thalmelatine
/ (+)-Thalmelatine
C00029236 External link 512 Waziristanine
C00039457 External link 512 Isothalicrine
/ (+)-Isothalicrine
C00039459 External link 512 Isothalirine
C00040813 External link 512 3',5'-Dihydroxythalifaboramine
/ (+)-3',5'-Dihydroxythalifaboramine
C00040819 External link 512 3-Hydroxy-6'-desmethyl-9-O-methylthalifaboramine
CHEMBL1171064
C00040820 External link 512 3-Hydroxy-6'-desmethylthalifaboramine
/ (+)-3-Hydroxy-6'-desmethylthalifaboramine
C00040824 External link 512 3-Hydroxythalifaboramine
/ (+)-3-Hydroxythalifaboramine
CHEMBL1171065
C00040840 External link 512 5'-Hydroxythalifaboramine
/ (+)-5'-Hydroxythalifaboramine
C00041208 External link 512 Thaligrisine
/ (+)-Thaligrisine
CHEMBL1186148
C00049607 External link 512 3-Methoxyfaurithaline
/ (+)-3-Methoxyfaurithaline
C00049637 External link 512 Fauripavine
/ (+)-Fauripavine
C00049638 External link 512 Faurithaline
/ (+)-Faurithaline

Human Protein / Gene in interactions

11 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
Q12809 Potassium voltage-gated channel subfamily H member 2 KCNH, Kv10-12.x (Ether-a-go-go) C00001845 C00025606 C00028131 2 / 2
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00001845 C00028131 0 / 0
P27695 DNA-(apurinic or apyrimidinic site) lyase Enzyme C00025930 0 / 0
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00025930 1 / 2
P14618 Pyruvate kinase PKM Enzyme C00025930 0 / 0
Q9UIF8 Bromodomain adjacent to zinc finger domain protein 2B Unclassified protein C00025930 0 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00025930 4 / 3
B2RXH2 Lysine-specific demethylase 4E Enzyme C00025930 0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00025930 0 / 0
Q9NUW8 Tyrosyl-DNA phosphodiesterase 1 Enzyme C00025930 1 / 1
O00255 Menin Unclassified protein C00025930 2 / 5

1 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
1576 CYP3A4, CP33, CP34, CYP3A, CYP3A3, CYPIIIA3, CYPIIIA4, HLP, NF-25, P450C3, P450PCN1 cytochrome P450, family 3, subfamily A, polypeptide 4 (EC:1.14.13.67 1.14.13.97 1.14.13.32 1.14.13.157) C00001845 C00028131

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (10)

OMIM preferred title UniProt
#600274 Frontotemporal dementia; ftd P10636
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#613688 Long qt syndrome 2; lqt2 Q12809
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#609620 Short qt syndrome 1; sqt1 Q12809
#607250 Spinocerebellar ataxia, autosomal recessive, with axonal neuropathy; scan1 Q9NUW8
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636

KEGG DISEASE (13)

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)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (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)
H00720 Long QT syndrome Q12809 (related)
H00725 Short QT syndrome Q12809 (related)
H00063 Spinocerebellar ataxia (SCA) Q9NUW8 (related)

Diseases related to CTD interactions

2 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D001145 Arrhythmias, Cardiac C00001845
C00028131
D056486 Drug-Induced Liver Injury C00001845
C00028131