KCF-S cluster No. 606 (14 metabolites)

Corresponding Phytochemical cluster No. 25


Plant Species


Cumulative plant class count

class name count
asterids 111
rosids 59
Liliopsida 2

Cumulative family count

class name count
Apiaceae 108
Rutaceae 28
Moraceae 28
Aspergillaceae 5
Asteraceae 3
Fabaceae 2
Rosaceae 1
Poaceae 1
Cyperaceae 1

KEGG BRITE br08003 External link 512


Categories (1)

br08003 Category # of metabolite
Furanocoumarins 4

metabolites link (4)

br08003 Category KEGG ID KNApSAcK ID
Furanocoumarins C02162 C00000583
Furanocoumarins C09053 C00002448
Furanocoumarins C09269 C00002477
Furanocoumarins C09285 C00002493

Metabolite list (14)

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
C00000583 External link 512 Isopimpinellin
CHEMBL140796
C015304
9 / 3 / 4 2 / 0
C00002448 External link 512 Alloimperatorin
C00002477 External link 512 Imperatorin
CHEMBL453805
C031534
18 / 7 / 6 1 / 1
C00002493 External link 512 Pimpinellin
CHEMBL1491809
C039409
3 / 0 / 1
C00030531 External link 512 Isogosferol
/ Isogospherol
/ (+)-Isogospherol
C00030532 External link 512 Isoimperatorin
CHEMBL448060
C055542
8 / 13 / 11 3 / 1
C00030987 External link 512 Phellopterin
CHEMBL452751
C104601
7 / 18 / 10
C00032846 External link 512 Cnidilin
/ Knidilin
/ Isophellopterin
CHEMBL1934194
1 / 0 / 0
C00033282 External link 512 Pabulenol
CHEMBL1870203
C00037872 External link 512 Swietenocoumarin B
C00043481 External link 512 E-Imperatorin acid
CHEMBL487409
C00043493 External link 512 E-Trichoclin
CHEMBL527099
CHEMBL487408
C00044024 External link 512 Z-Imperatorin acid
CHEMBL487409
C00044026 External link 512 Z-Trichoclin
CHEMBL527099
CHEMBL487408

Human Protein / Gene in interactions

33 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
P56817 Beta-secretase 1 A1A C00000583 C00002477 C00030532 C00030987 C00032846 0 / 0
Q13148 TAR DNA-binding protein 43 Unclassified protein C00000583 C00002477 C00030532 C00030987 1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 C00000583 C00002477 C00002493 0 / 1
P00352 Retinal dehydrogenase 1 Enzyme C00002477 C00002493 C00030532 0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00002477 C00030532 0 / 0
P27695 DNA-(apurinic or apyrimidinic site) lyase Enzyme C00000583 C00002477 0 / 0
O94782 Ubiquitin carboxyl-terminal hydrolase 1 Enzyme C00002477 0 / 0
P51452 Dual specificity protein phosphatase 3 Ser_Thr_Tyr C00002477 0 / 0
Q9NR56 Muscleblind-like protein 1 Unclassified protein C00030987 1 / 0
P11473 Vitamin D3 receptor NR1I1 C00002477 2 / 3
P37840 Alpha-synuclein Unclassified protein C00030987 4 / 2
Q92830 Histone acetyltransferase KAT2A Enzyme C00000583 0 / 0
P11413 Glucose-6-phosphate 1-dehydrogenase Enzyme C00030987 1 / 2
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor C00002477 0 / 0
P63092 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short Other membrane protein C00030987 7 / 3
P83916 Chromobox protein homolog 1 Unclassified protein C00002477 0 / 0
P34969 5-hydroxytryptamine receptor 7 Serotonin receptor C00002477 0 / 0
P35236 Tyrosine-protein phosphatase non-receptor type 7 Tyr C00002477 0 / 0
P02545 Prelamin-A/C Unclassified protein C00030532 11 / 10
P15428 15-hydroxyprostaglandin dehydrogenase [NAD(+)] Enzyme C00000583 2 / 2
P22303 Acetylcholinesterase Hydrolase C00030532 1 / 0
P16050 Arachidonate 15-lipoxygenase Enzyme C00002493 0 / 0
P10253 Lysosomal alpha-glucosidase Hydrolase C00002477 1 / 1
Q9UNA4 DNA polymerase iota Enzyme C00030532 0 / 0
O75164 Lysine-specific demethylase 4A Enzyme C00002477 0 / 0
P06746 DNA polymerase beta Enzyme C00000583 0 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00030987 4 / 3
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00000583 0 / 0
B2RXH2 Lysine-specific demethylase 4E Enzyme C00000583 0 / 0
O00167 Eyes absent homolog 2 Enzyme C00002477 0 / 0
P49798 Regulator of G-protein signaling 4 Unclassified protein C00002477 2 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme C00002477 1 / 0
Q9UIF8 Bromodomain adjacent to zinc finger domain protein 2B Unclassified protein C00030532 0 / 0

4 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
1545 CYP1B1, CP1B, CYPIB1, GLC3A, P4501B1 cytochrome P450, family 1, subfamily B, polypeptide 1 (EC:1.14.14.1) C00000583 C00002477 C00030532
2939 GSTA2, GST2, GSTA2-2, GTA2, GTH2 glutathione S-transferase alpha 2 (EC:2.5.1.18) C00030532
8856 NR1I2, BXR, ONR1, PAR, PAR1, PAR2, PARq, PRR, PXR, SAR, SXR nuclear receptor subfamily 1, group I, member 2 C00000583
3162 HMOX1, HMOX1D, HO-1, HSP32, bK286B10 heme oxygenase (decycling) 1 (EC:1.14.99.3) C00030532

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (38)

OMIM preferred title UniProt
#219080 Acth-independent macronodular adrenal hyperplasia; aimah P63092
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#300908 Anemia, nonspherocytic hemolytic, due to g6pd deficiency P11413
#115200 Cardiomyopathy, dilated, 1a; cmd1a P02545
#212112 Cardiomyopathy, dilated, with hypergonadotropic hypogonadism P02545
#605588 Charcot-marie-tooth disease, axonal, type 2b1; cmt2b1 P02545
#127750 Dementia, lewy body; dlb P37840
#119900 Digital clubbing, isolated congenital P15428
#181350 Emery-dreifuss muscular dystrophy 2, autosomal dominant; edmd2 P02545
#600274 Frontotemporal dementia; ftd P10636
#137800 Glioma susceptibility 1; glm1 O75874
#232300 Glycogen storage disease ii P10253
#610140 Heart-hand syndrome, slovenian type P02545
#176670 Hutchinson-gilford progeria syndrome; hgps P02545
#259100 Hypertrophic osteoarthropathy, primary, autosomal recessive, 1; phoar1 P15428
#151660 Lipodystrophy, familial partial, type 2; fpld2 P02545
#248370 Mandibuloacral dysplasia with type a lipodystrophy; mada P02545
#174800 Mccune-albright syndrome; mas P63092
#613205 Muscular dystrophy, congenital, lmna-related P02545
#159001 Muscular dystrophy, limb-girdle, type 1b; lgmd1b P02545
#607948 Mycobacterium tuberculosis, susceptibility to P11473
#160900 Myotonic dystrophy 1; dm1 Q9NR56
#166350 Osseous heteroplasia, progressive; poh P63092
#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
#102200 Pituitary adenoma, growth hormone-secreting P63092
#103580 Pseudohypoparathyroidism, type ia; php1a P63092
#603233 Pseudohypoparathyroidism, type ib; php1b P63092
#612462 Pseudohypoparathyroidism, type ic; php1c P63092
#275210 Restrictive dermopathy, lethal P02545
#604906 Schizophrenia 9; sczd9 P49798
#181500 Schizophrenia; sczd P49798
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636
#277440 Vitamin d-dependent rickets, type 2a; vddr2a P11473
#112100 Yt blood group antigen P22303

KEGG DISEASE (27)

KEGG name UniProt
H00264 Charcot-Marie-Tooth disease (CMT) P02545 (related)
H00294 Dilated cardiomyopathy (DCM) P02545 (related)
H00420 Familial partial lipodystrophy (FPL) P02545 (related)
H00563 Emery-Dreifuss muscular dystrophy P02545 (related)
H00590 Congenital muscular dystrophies (CMD/MDC) P02545 (related)
H00593 Limb-girdle muscular dystrophy (LGMD) P02545 (related)
H00601 Hutchinson-Gilford progeria syndrome P02545 (related)
H00663 Restrictive dermopathy P02545 (related)
H00665 Mandibuloacral dysplasia P02545 (related)
H01216 Left ventricular noncompaction (LVNC) P02545 (related)
H00036 Osteosarcoma P08684 (marker)
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)
H00101 Other phagocyte defects P11413 (related)
H00668 Anemia due to disorders of glutathione metabolism P11413 (related)
H00342 Tuberculosis P11473 (related)
H00784 Localized autosomal recessive hypotrichosis P11473 (related)
H01143 Vitamin D-dependent rickets P11473 (related)
H00457 Primary hypertrophic osteoarthropathy (PHO) P15428 (related)
H01246 Isolated congenital nail clubbing (ICNC) P15428 (related)
H00057 Parkinson's disease (PD) P37840 (related)
H00066 Lewy body dementia (LBD) P37840 (related)
H00244 Pseudohypoparathyroidism P63092 (related)
H00441 Progressive osseous heteroplasia (POH) P63092 (related)
H00501 Fibrous dysplasia, polyostotic P63092 (related)

Diseases related to CTD interactions

1 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D056486 Drug-Induced Liver Injury C00002477
C00030532