KCF-S cluster No. 220 (29 metabolites)

Corresponding Phytochemical cluster No. 11



Metabolite list (29)

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
C00003682 External link 512 Cucurbitacin A
CHEMBL455518
1 / 1 / 2
C00003683 External link 512 Cucurbitacin B
CHEMBL367917
CHEMBL508185
CHEMBL507237
CHEMBL1708265
CHEMBL1728549
C041246
22 / 30 / 28
C00003684 External link 512 Cucurbitacin C
CHEMBL449220
CHEMBL1355541
12 / 9 / 9
C00003685 External link 512 Cucurbitacin D
CHEMBL493646
CHEMBL492404
C038105
1 / 0 / 0
C00003686 External link 512 Cucurbitacin E
CHEMBL455056
C102326
3 / 1 / 2
C00003687 External link 512 Cucurbitacin F
CHEMBL488312
CHEMBL1730681
C453923
8 / 4 / 1
C00003688 External link 512 Cucurbitacin H
CHEMBL551160
CHEMBL1163012
1 / 1 / 2
C00003689 External link 512 Cucurbitacin I
CHEMBL387737
CHEMBL1317135
CHEMBL1717364
C038106
20 / 15 / 15 2 / 0
C00003690 External link 512 Cucurbitacin J
CHEMBL1923789
CHEMBL1923790
CHEMBL1984707
C00003691 External link 512 Cucurbitacin O
CHEMBL488312
CHEMBL1730681
8 / 4 / 1
C00003692 External link 512 Cucurbitacin P
CHEMBL422755
CHEMBL486260
C00003693 External link 512 Cucurbitacin Q
CHEMBL447610
CHEMBL1965785
C00003695 External link 512 11-Deoxocucurbitacin I
C00030028 External link 512 Cucurbitacin B 2-sulfate
C00031748 External link 512 Dihydrocucurbitacin B
CHEMBL553851
1 / 1 / 2
C00031749 External link 512 Dihydrocucurbitacin E
CHEMBL256519
C00031750 External link 512 Dihydrocucurbitacin I
CHEMBL480111
1 / 0 / 0
C00034445 External link 512 Bacobitacin A
/ (-)-Bacobitacin A
C00034446 External link 512 Bacobitacin B
/ (-)-Bacobitacin B
C00035843 External link 512 Isocucurbitacin R
CHEMBL563715
1 / 1 / 2
C00039029 External link 512 Hemslecin B
/ Dihydrocucurbitacin F
CHEMBL422755
CHEMBL486260
C00041248 External link 512 16-Deoxycucurbitacin B
/ (+)-16-Deoxycucurbitacin B
CHEMBL503027
C00044429 External link 512 25-Acetylcucurbitacin F
CHEMBL506658
C00044430 External link 512 2-Deoxycucurbitacin D
CHEMBL493647
C00046712 External link 512 Deacetylpicracin
CHEMBL487390
C00046860 External link 512 Picracin
CHEMBL506658
C00047823 External link 512 Cucurbitacin G
CHEMBL551160
CHEMBL1163012
1 / 1 / 2
C00047824 External link 512 Cucurbitacin R
CHEMBL403003
CHEMBL564629
2 / 1 / 2
C00047845 External link 512 Dihydroisocucurbitacin B
CHEMBL556138
1 / 1 / 2

Human Protein / Gene in interactions

34 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
P40763 Signal transducer and activator of transcription 3 Transcription Factor C00003682 C00003683 C00003686 C00003688 C00031748 C00035843 C00047823 C00047824 C00047845 1 / 2
P20701 Integrin alpha-L Membrane receptor C00003683 C00003685 C00003686 C00003689 C00031750 C00047824 0 / 0
Q99700 Ataxin-2 Unclassified protein C00003683 C00003684 C00003687 C00003689 C00003691 1 / 1
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme C00003683 C00003684 C00003687 C00003689 C00003691 1 / 0
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein C00003683 C00003684 C00003687 C00003689 C00003691 2 / 0
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00003683 C00003684 C00003687 C00003689 C00003691 0 / 0
O75496 Geminin Unclassified protein C00003683 C00003684 C00003687 C00003689 C00003691 0 / 0
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00003683 C00003684 C00003687 C00003691 0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor C00003683 C00003687 C00003689 C00003691 0 / 0
P11473 Vitamin D3 receptor NR1I1 C00003683 C00003684 C00003689 2 / 3
P83916 Chromobox protein homolog 1 Unclassified protein C00003683 C00003687 C00003691 0 / 0
Q06710 Paired box protein Pax-8 Unclassified protein C00003683 C00003684 C00003689 1 / 2
O15118 Niemann-Pick C1 protein Unclassified protein C00003683 C00003684 1 / 1
Q16637 Survival motor neuron protein Unclassified protein C00003683 C00003689 4 / 1
P51151 Ras-related protein Rab-9A Unclassified protein C00003683 C00003684 0 / 0
P23528 Cofilin-1 Unclassified protein C00003686 C00003689 0 / 0
P42858 Huntingtin Unclassified protein C00003683 1 / 1
P11387 DNA topoisomerase 1 Isomerase C00003683 0 / 0
P11308 Transcriptional regulator ERG Unclassified protein C00003689 1 / 2
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00003684 1 / 2
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 C00003689 0 / 1
Q9HC16 DNA dC->dU-editing enzyme APOBEC-3G Enzyme C00003683 0 / 0
P05177 Cytochrome P450 1A2 Cytochrome P450 1A2 C00003689 0 / 0
Q16665 Hypoxia-inducible factor 1-alpha Transcription Factor C00003689 0 / 0
P02545 Prelamin-A/C Unclassified protein C00003683 11 / 10
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 C00003689 1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 C00003689 0 / 1
Q9UNA4 DNA polymerase iota Enzyme C00003684 0 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00003683 4 / 3
Q13315 Serine-protein kinase ATM Atypical serine/threonine protein kinase PIKK subfamily C00003683 1 / 4
P31939 Bifunctional purine biosynthesis protein PURH Enzyme C00003689 1 / 1
P39748 Flap endonuclease 1 Enzyme C00003683 0 / 0
P01215 Glycoprotein hormones alpha chain Unclassified protein C00003689 0 / 3
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 C00003689 1 / 0

2 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
3717 JAK2, JTK10, THCYT3 Janus kinase 2 (EC:2.7.10.2) C00003689
6774 STAT3, APRF, HIES signal transducer and activator of transcription 3 (acute-phase response factor) C00003689

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (35)

OMIM preferred title UniProt
#608688 Aicar transformylase/imp cyclohydrolase deficiency P31939
#208900 Ataxia-telangiectasia; at Q13315
#115200 Cardiomyopathy, dilated, 1a; cmd1a P02545
#212112 Cardiomyopathy, dilated, with hypergonadotropic hypogonadism P02545
#605588 Charcot-marie-tooth disease, axonal, type 2b1; cmt2b1 P02545
#114500 Colorectal cancer; crc P84022
#609535 Drug metabolism, poor, cyp2c19-related P33261
#608902 Drug metabolism, poor, cyp2d6-related P10635
#181350 Emery-dreifuss muscular dystrophy 2, autosomal dominant; edmd2 P02545
#612219 Ewing sarcoma; es P11308
#600274 Frontotemporal dementia; ftd P10636
#137800 Glioma susceptibility 1; glm1 O75874
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#610140 Heart-hand syndrome, slovenian type P02545
#143100 Huntington disease; hd P42858
#176670 Hutchinson-gilford progeria syndrome; hgps P02545
#147060 Hyper-ige recurrent infection syndrome, autosomal dominant P40763
#218700 Hypothyroidism, congenital, nongoitrous, 2; chng2 Q06710
#151660 Lipodystrophy, familial partial, type 2; fpld2 P02545
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#248370 Mandibuloacral dysplasia with type a lipodystrophy; mada P02545
#613205 Muscular dystrophy, congenital, lmna-related P02545
#159001 Muscular dystrophy, limb-girdle, type 1b; lgmd1b P02545
#607948 Mycobacterium tuberculosis, susceptibility to P11473
#257220 Niemann-pick disease, type c1; npc1 O15118
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#275210 Restrictive dermopathy, lethal P02545
#253300 Spinal muscular atrophy, type i; sma1 Q16637
#253550 Spinal muscular atrophy, type ii; sma2 Q16637
#253400 Spinal muscular atrophy, type iii; sma3 Q16637
#271150 Spinal muscular atrophy, type iv; sma4 Q16637
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636
#277440 Vitamin d-dependent rickets, type 2a; vddr2a P11473

KEGG DISEASE (38)

KEGG name UniProt
H00136 Niemann-Pick disease type C (NPC) O15118 (related)
H00081 Hashimoto's thyroiditis P01215 (marker)
H00082 Graves' disease P01215 (marker)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P01215 (marker)
Q06710 (related)
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)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (related)
H00024 Prostate cancer P11308 (related)
H00035 Ewing's sarcoma P11308 (related)
H00342 Tuberculosis P11473 (related)
H00784 Localized autosomal recessive hypotrichosis P11473 (related)
H01143 Vitamin D-dependent rickets P11473 (related)
H01205 Coumarin resistance P11712 (related)
H00966 AICA-ribosiduria P31939 (related)
H01171 Poor drug metabolism (PM) P33261 (related)
H00016 Oral cancer P40763 (related)
H00107 Other well-defined immunodeficiency syndromes P40763 (related)
H00059 Huntington's disease (HD) P42858 (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)
H00032 Thyroid cancer Q06710 (related)
H00005 Chronic lymphocytic leukemia (CLL) Q13315 (related)
H00064 Ataxia telangiectasia (AT) Q13315 (related)
H00094 DNA repair defects Q13315 (related)
H00848 Ataxia with ocular apraxia (AOA) Q13315 (related)
H00455 Spinal muscular atrophy (SMA) Q16637 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)