KCF-S cluster No. 114 (43 metabolites)

Corresponding Phytochemical cluster No. 59

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (43)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

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Cumulative plant class count

class name	count
rosids	25
asterids	23
eudicotyledons	5
Liliopsida	5
Viridiplantae	3

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Cumulative family count (Top 20)

class name	count
Solanaceae	14
Corbiculidae	14
Rosaceae	10
Convolvulaceae	5
Liliaceae	4
Brassicaceae	3
Ranunculaceae	3
Passifloraceae	3
Gymnodiniaceae	3
Papaveraceae	2
Euglenaceae	2
Gobiidae	2
Fabaceae	2
Cucurbitaceae	2
Asteraceae	2
Orobanchaceae	1
Fucaceae	1
Oleaceae	1
Dictyotaceae	1
Rutaceae	1

KEGG BRITE br08003

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Categories (1)

br08003 Category	# of metabolite
Carotenoids	7

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metabolites link (7)

br08003 Category	KEGG ID	KNApSAcK ID
Carotenoids	C08579	C00003760
Carotenoids	C08585	C00003764
Carotenoids	C08596	C00003773
Carotenoids	C08602	C00003777
Carotenoids	C08606	C00003780
Carotenoids	C08614	C00003787
Carotenoids	C13433	C00045500

Metabolite list (43)

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
C00003760	Antheraxanthin / (3R,5R,6S,3'R)-zeaxanthin 5,6-epoxide		C031140
C00003764	Capsorubin		C035624
C00003773	Fucoxanthin	CHEMBL1575074	C025164	12 / 17 / 46	6 / 3
C00003777	taraxanthin / Lutein 5,6-epoxide
C00003780	Neoxanthin / Folioxanthin		C011947		4 / 0
C00003787	Violaxanthin		C005613
C00022925	Heteroxanthin / (3S,3'R,5R,6R)-7',8'-Didehydro-5,6-dihydro-3,3',5,6-tetrahydroxy-beta,beta-carotene
C00022926	Karpoxanthin / Carpoxanthin / (3S,3'R,5R,6R)-5,6-Dihydro-3,3',5,6-tetrahydroxy-beta,beta-carotene
C00022927	6-Epiheteroxanthin / (3S,3'R,5R,6S)-5,6-Dihydro-3,3',5,6-tetrahydroxy-beta,beta-carotene
C00022928	(3S,3'R,5S,6S)-5,6-Dihydro-3,3',5,6-tetrahydroxy-beta,beta-carotene
C00022932	(3S,3'S,5R,5'R,6S,6'R)-6,7-Didehydro-5,5',6,6'-tetrahydro-3,3',5,5',6'-pentahydroxy-beta,beta-carotene
C00022933	Neoflor / (3S,3'S,5R,5'R,6R,6'R)-6,7-Didehydro-5,5',6,6'-tetrahydro-3,3',5,5',6'-pentahydroxy-beta,beta-carotene
C00022934	Mactraxanthin / (3S,3'S,5R,5'R,6R,6'R)-5,5',6,6'-Tetrahydro-3,3',5,5',6,6'-hexahydroxy-beta,beta-carotene
C00022941	Diadinoxanthin / (3S,3'R,5R,6S)-7',8'-Didehydro-5,6-epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol		C033808
C00022942	Diadinoxanthin B / (3S,3'R,5S,6R)-7',8'-Didehydro-5,6-epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol
C00022943	Antheraxanthin B / (3S,3'R,5S,6R)-5,6-Epoxy-5,6-dihydro-beta,beta-carotene-3,3'-diol
C00022944	Dinoxanthin / (3S,3'S,5R,5'R,6S,6'S)-6,7-Didehydro-5',6'-epoxy-5',6'-dihydro-beta,beta-carotene-3,3',5(6H)-triol 3-acetate
C00022945	Latoxanthin / (3S,3'S,5R,5'R,6R,6'S)-5,6-Epoxy-5,5',6,6'-tetrahydro-3,3',5',6'-tetrahydroxy-beta,beta-carotene
C00022946	5,6-Diepilatoxanthin / (3S,3'S,5S,5'R,6S,6'S)-5',6'-Epoxy-5,5',6,6'-tetrahydro-3,3',5,5'-tetrahydroxy-beta,beta-carotene
C00022947	Vaucheriaxanthin / 6,7-Didehydro-5',6'-epoxy-5,5',6,6'-tetrahydro-3,3',5,19'-tetrahydroxy-beta,beta-carotene
C00022948	Cucurbitaxanthin A / (3S,3'R,5R,6R)-3,6-Epoxy-5,6-dihydro-3',5-dihydroxy-beta,beta-carotene
C00022951	Latochrome / (3S,3'S,5R,5'R,6R)-5',8'-Epoxy-5,5',6,8'-tetrahydro-3,3',5,6-tetrahydroxy-beta,beta-carotene
C00022952	(5R,5'R,6S,6'S)-5,6:5',6'-Diepoxy-5,5',6,6'-tetrahydro-beta,beta-carotene
C00022953	Cryptoxanthin diepoxide / 5,6:5',6'-Diepoxy-5,5',6,6'-tetrahydro-beta-caroten-3-ol
C00022954	Cucurbitaxanthin B / (3S,3'S,5R,5'R,6R,6'S)-3,6:4',5'-Diepoxy-5,5',6,6'-tetrahydro-3',5-dihydroxy-beta,beta-carotene
C00022955	Cycloviolaxanthin / (3S,3'S,5R,5'R,6R,6'R)-3,6:3',6'-Diepoxy-5,5',6,6'-tetrahydro-5,5'-dihydroxy-beta,beta-carotene
C00022956	Curcurbitachrome 1 / (3S,3'S,5R,5'R,6R,8'R)-3,6:5',8'-Diepoxy-5,5',6,8'-tetrahydro-3',5-dihydroxy-beta,beta-carotene
C00023029	5,6-Diepicapsokarpoxanthin / (3S,3'S,5S,5'R,6S)-5,6-Dihydro-3,3',5,6-tetrahydroxy-beta,kappa-caroten-6'-one
C00023033	Halocynthiaxanthin / (3S,3'R,5R,6S)-7',8'-Didehydro-5,6-epoxy-5,6,7,8-tetrahydro-8-oxo-beta,beta-carotene-3,3'-diol	CHEMBL450953	C073045
C00023034	Preprasinoxanthin / (3S,3'R,5R,6S,6'R)-5,6-Epoxy-5,6,7,8-tetrahydro-8-oxo-beta,epsilon-carotene-3,3'-diol
C00023035	Capsanthin 5,6-epoxide / (3S,5R,6S,3'S,5'R)-5,6-Epoxy-5,6-dihydro-3,3'-dihydroxy-beta,kappa-caroten-6'-one
C00023036	Dihydroprasinoxanthin epoxide / (3S,3'R,4'S,5'R,6R,6'R)-5,18-Didehydro-4',5'-epoxy-5,5',6,6',7,7',8,8'-octahydro-3,3',6-trihydroxy-8-oxo-beta,beta-carotene
C00023037	19'-Hydroxyfucoxanthinol / (3S,3'S,5R,5'R,6S,6'R)-6',7'-Didehydro-5,6-epoxy-5',6,6',7-tetrahydro-3,3',5',19'-tetrahydroxy-beta,beta-caroten-8(5H)-one
C00023038	19-Hexanoyloxyfucoxanthinol / (3S,3'S,5R,5'R,6S,6'R)-6',7'-Didehydro-5,6-epoxy-5',6,6',7-tetrahydro-3,3',5'-trihydroxy-19'-[(1-oxohexyl)oxy]-beta,beta-carotene
C00023042	Capsanthin 3,6-epoxide / (3S,3'S,5R,5'R,6R)-3,6-Epoxy-5,6-dihydro-3',5-dihydroxy-beta,kappa-caroten-6'-one
C00023237	6-Epiheteroxanthin
C00023238	Diatoxanthin 3,6-epoxide
C00023240	Fucoxanthinol		C483031
C00034544	Ipomoeaxanthin A
C00034545	Ipomoeaxanthin B
C00034546	Ipomoeaxanthin C1
C00034547	Ipomoeaxanthin C2
C00045500	(9Z)-Violaxanthin

Human Protein / Gene in interactions

12 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
P04637	Cellular tumor antigen p53	Transcription Factor	C00003773	7 / 37
Q99700	Ataxin-2	Unclassified protein	C00003773	1 / 1
P07550	Beta-2 adrenergic receptor	Adrenergic receptor	C00003773	0 / 1
P11473	Vitamin D3 receptor	NR1I1	C00003773	2 / 3
P84022	Mothers against decapentaplegic homolog 3	Unclassified protein	C00003773	2 / 0
O75496	Geminin	Unclassified protein	C00003773	0 / 0
P06280	Alpha-galactosidase A	Enzyme	C00003773	1 / 1
P10636	Microtubule-associated protein tau	Unclassified protein	C00003773	4 / 3
Q16236	Nuclear factor erythroid 2-related factor 2	Unclassified protein	C00003773	0 / 0
B2RXH2	Lysine-specific demethylase 4E	Enzyme	C00003773	0 / 0
P46063	ATP-dependent DNA helicase Q1	Enzyme	C00003773	0 / 0
Q96KQ7	Histone-lysine N-methyltransferase EHMT2	Enzyme	C00003773	0 / 0

9 Gene in CTD interactions

gene	gene name	gene description	KNApSAcK metabolite in interactions
836	CASP3, CPP32, CPP32B, SCA-1	caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56)	C00003773 C00003780
598	BCL2L1, BCL-XL/S, BCL2L, BCLX, BCLXL, BCLXS, Bcl-X, PPP1R52, bcl-xL, bcl-xS	BCL2-like 1	C00003773
841	CASP8, ALPS2B, CAP4, Casp-8, FLICE, MACH, MCH5	caspase 8, apoptosis-related cysteine peptidase (EC:3.4.22.61)	C00003780
842	CASP9, APAF-3, APAF3, ICE-LAP6, MCH6, PPP1R56	caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62)	C00003780
9131	AIFM1, AIF, CMTX4, COWCK, COXPD6, PDCD8	apoptosis-inducing factor, mitochondrion-associated, 1	C00003780
840	CASP7, CASP-7, CMH-1, ICE-LAP3, LICE2, MCH3	caspase 7, apoptosis-related cysteine peptidase (EC:3.4.22.60)	C00003773
2697	GJA1, AVSD3, CMDR, CX43, DFNB38, GJAL, HLHS1, HSS, ODDD	gap junction protein, alpha 1, 43kDa	C00003773
2705	GJB1, CMTX, CMTX1, CX32	gap junction protein, beta 1, 32kDa	C00003773
3162	HMOX1, HMOX1D, HO-1, HSP32, bK286B10	heme oxygenase (decycling) 1 (EC:1.14.99.3)	C00003773

Related Diseases

Diseases related to proteins in ChEMBL interactions

Diseases related to CTD interactions