KCF-S cluster No. 300 (22 metabolites)

Corresponding Phytochemical cluster No. 68

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (22)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

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Cumulative plant class count

class name	count
asterids	11
Liliopsida	5
rosids	2
Viridiplantae	1

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Cumulative family count

class name	count
Boraginaceae	10
Corallinaceae	9
Poaceae	5
Delesseriaceae	2
Dumontiaceae	2
Brassicaceae	2
Ceramiaceae	2
Rhodomelaceae	2
Gracilariaceae	2
Solieriaceae	1
Anadyomenaceae	1
Saprolegniaceae	1
Solanaceae	1
Nostocaceae	1

KEGG BRITE br08003

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Categories (1)

br08003 Category	# of metabolite
Unsaturated fatty acids	1

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metabolites link (1)

br08003 Category	KEGG ID	KNApSAcK ID
Unsaturated fatty acids	C06426	C00001226

Metabolite list (22)

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
C00000182	12S-HETE / 12S-Hydroxyeicosatetraenoic acid	CHEMBL1435825 CHEMBL1526258		3 / 1 / 4
C00000363	(12S,13S)-EOD / (12S,13S)-Epoxylinolenic acid
C00000364	(13S)-HPLA / 13(S)-Hydroperoxylinolenic acid / (13S)-Hydroperoxy-cis-9,15-trans-11-octadecatrienoic acid
C00000386	9R-Hydroxy-10E,12Z,15Z-Octadecatrienoic acid
C00000389	13S-Hydroperoxy-9Z,11E,15Z-octadecatrienoic acid
C00000400	15S-Hydroperoxyeicosatetraenoic acid	CHEMBL88222 CHEMBL1606580		4 / 3 / 4
C00000416	12S-HEPE / 12S-Hydroxyeicosapentaenoic acid
C00000419	Divinylether polyneuric acid
C00000420	9S-HETE / 9S-Hydroxyarachidonic acid
C00000422	8R-HPETE
C00000423	5-HETE / 5-Hydroxyarachidonic acid	CHEMBL17695 CHEMBL164813		3 / 4 / 3
C00000424	12-HETE / 12-Hydroxyarachidonic acid	CHEMBL1435825 CHEMBL1526258		3 / 1 / 4
C00000425	11-HETE / 11-Hydroxyarachidonic acid	CHEMBL458854
C00000426	13-HAA / 13-Hydroxyarachidonic acid
C00000427	15-HETE / 15-Hydroxyarachidonic acid	CHEMBL594621		1 / 0 / 0
C00000433	5Z,8Z,10E,12E,14Z-Eicosapentaenoic acid
C00000435	(11R)-Hydroxy-6(Z),9(Z),12(Z)-octadecatrienoic acid		C078213
C00000438	5Z,7E,9E,14Z,17Z-Eicosapentaenoic acid
C00000439	Ptilodene
C00000448	Colnelenic acid		C118818
C00001226	gamma-Linolenic acid / 6(Z),9(Z),12(Z)-Octadecatrienoic acid	CHEMBL464982	D017965	17 / 8 / 5	42 / 0
C00048303	9-Hydroxy-(10E,12Z,15Z)-octadecatrienoic acid		C062142

Human Protein / Gene in interactions

24 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
Q96KQ7	Histone-lysine N-methyltransferase EHMT2	Enzyme	C00000182 C00000424 C00001226	0 / 0
Q01196	Runt-related transcription factor 1	Unclassified protein	C00000182 C00000400 C00000424	1 / 4
Q13951	Core-binding factor subunit beta	Unclassified protein	C00000182 C00000400 C00000424	0 / 1
P49798	Regulator of G-protein signaling 4	Unclassified protein	C00000400 C00001226	2 / 0
P13726	Tissue factor	Membrane receptor	C00001226	0 / 0
P11473	Vitamin D3 receptor	NR1I1	C00001226	2 / 3
Q92830	Histone acetyltransferase KAT2A	Enzyme	C00001226	0 / 0
P43220	Glucagon-like peptide 1 receptor	Glucagon-like peptide receptor	C00001226	0 / 0
Q9Y253	DNA polymerase eta	Enzyme	C00001226	1 / 1
Q9Y468	Lethal(3)malignant brain tumor-like protein 1	Unclassified protein	C00001226	0 / 0
P83916	Chromobox protein homolog 1	Unclassified protein	C00001226	0 / 0
O94782	Ubiquitin carboxyl-terminal hydrolase 1	Enzyme	C00001226	0 / 0
P49327	Fatty acid synthase	Transferase	C00001226	0 / 0
Q9Y2Q3	Glutathione S-transferase kappa 1	Enzyme	C00000400	0 / 0
Q9UNA4	DNA polymerase iota	Enzyme	C00001226	0 / 0
P27695	DNA-(apurinic or apyrimidinic site) lyase	Enzyme	C00000427	0 / 0
P10636	Microtubule-associated protein tau	Unclassified protein	C00000423	4 / 3
Q9UBT6	DNA polymerase kappa	Enzyme	C00001226	0 / 0
Q13526	Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1	Enzyme	C00001226	0 / 0
O75874	Isocitrate dehydrogenase [NADP] cytoplasmic	Enzyme	C00001226	1 / 0
P09917	Arachidonate 5-lipoxygenase	Oxidoreductase	C00000423	0 / 0
O14880	Microsomal glutathione S-transferase 3	Enzyme	C00000423	0 / 0
O94925	Glutaminase kidney isoform, mitochondrial	Enzyme	C00001226	0 / 0
Q14191	Werner syndrome ATP-dependent helicase	Enzyme	C00001226	2 / 1

42 Gene in CTD interactions

gene	gene name	gene description	KNApSAcK metabolite in interactions
1645	AKR1C1, 2-ALPHA-HSD, 20-ALPHA-HSD, C9, DD1, DD1/DD2, DDH, DDH1, H-37, HAKRC, HBAB, MBAB	aldo-keto reductase family 1, member C1 (EC:1.3.1.20 1.1.1.149 1.1.1.112)	C00001226
1109	AKR1C4, 3-alpha-HSD, C11, CDR, CHDR, DD-4, DD4, HAKRA	aldo-keto reductase family 1, member C4 (EC:1.1.1.225 1.1.1.357)	C00001226
350	APOH, B2G1, B2GP1, BG	apolipoprotein H (beta-2-glycoprotein I)	C00001226
367	AR, AIS, DHTR, HUMARA, HYSP1, KD, NR3C4, SBMA, SMAX1, TFM	androgen receptor	C00001226
427	ASAH1, AC, ACDase, ASAH, PHP, PHP32, SMAPME	N-acylsphingosine amidohydrolase (acid ceramidase) 1 (EC:3.5.1.23)	C00001226
836	CASP3, CPP32, CPP32B, SCA-1	caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56)	C00001226
890	CCNA2, CCN1, CCNA	cyclin A2	C00001226
898	CCNE1, CCNE	cyclin E1	C00001226
983	CDK1, CDC2, CDC28A, P34CDC2	cyclin-dependent kinase 1 (EC:2.7.11.23 2.7.11.22)	C00001226
7122	CLDN5, AWAL, BEC1, CPETRL1, TMVCF	claudin 5	C00001226
1211	CLTA, LCA	clathrin, light chain A	C00001226
2495	FTH1, FHC, FTH, FTHL6, PIG15, PLIF	ferritin, heavy polypeptide 1 (EC:1.16.3.1)	C00001226
2729	GCLC, GCL, GCS, GLCL, GLCLC	glutamate-cysteine ligase, catalytic subunit (EC:6.3.2.2)	C00001226
2869	GRK5, GPRK5	G protein-coupled receptor kinase 5 (EC:2.7.11.16)	C00001226
3074	HEXB, ENC-1AS	hexosaminidase B (beta polypeptide) (EC:3.2.1.52)	C00001226
8334	HIST1H2AC, H2A/l, H2AFL, dJ221C16.4	histone cluster 1, H2ac	C00001226
3162	HMOX1, HMOX1D, HO-1, HSP32, bK286B10	heme oxygenase (decycling) 1 (EC:1.14.99.3)	C00001226
3558	IL2, IL-2, TCGF, lymphokine	interleukin 2	C00001226
3726	JUNB, AP-1	jun B proto-oncogene	C00001226
8942	KYNU	kynureninase (EC:3.7.1.3)	C00001226
5595	MAPK3, ERK-1, ERK1, ERT2, HS44KDAP, HUMKER1A, P44ERK1, P44MAPK, PRKM3, p44-ERK1, p44-MAPK	mitogen-activated protein kinase 3 (EC:2.7.11.24)	C00001226
4320	MMP11, SL-3, ST3, STMY3	matrix metallopeptidase 11 (stromelysin 3) (EC:3.4.24.-)	C00001226
4495	MT1G, MT1, MT1K	metallothionein 1G	C00001226
4500	MT1L, MT1, MT1R, MTF	metallothionein 1L (gene/pseudogene)	C00001226
4609	MYC, MRTL, MYCC, bHLHe39, c-Myc	v-myc avian myelocytomatosis viral oncogene homolog	C00001226
100506658	OCLN, BLCPMG	occludin (EC:2.1.1.67)	C00001226
5111	PCNA	proliferating cell nuclear antigen	C00001226
9124	PDLIM1, CLIM1, CLP-36, CLP36, hCLIM1	PDZ and LIM domain 1	C00001226
123	PLIN2, ADFP, ADRP	perilipin 2	C00001226
5465	PPARA, NR1C1, PPAR, PPARalpha, hPPAR	peroxisome proliferator-activated receptor alpha	C00001226
5468	PPARG, CIMT1, GLM1, NR1C3, PPARG1, PPARG2, PPARgamma	peroxisome proliferator-activated receptor gamma	C00001226
22949	PTGR1, LTB4DH, PGR1, ZADH3	prostaglandin reductase 1 (EC:1.3.1.48 1.3.1.74)	C00001226
5743	PTGS2, COX-2, COX2, GRIPGHS, PGG/HS, PGHS-2, PHS-2, hCox-2	prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1)	C00001226
6286	S100P, MIG9	S100 calcium binding protein P	C00001226
6502	SKP2, FBL1, FBXL1, FLB1, p45	S-phase kinase-associated protein 2, E3 ubiquitin protein ligase	C00001226
6520	SLC3A2, 4F2, 4F2HC, 4T2HC, CD98, CD98HC, MDU1, NACAE	solute carrier family 3 (amino acid transporter heavy chain), member 2	C00001226
6767	ST13, AAG2, FAM10A1, FAM10A4, HIP, HOP, HSPABP, HSPABP1, P48, PRO0786, SNC6	suppression of tumorigenicity 13 (colon carcinoma) (Hsp70 interacting protein)	C00001226
7033	TFF3, ITF, P1B, TFI	trefoil factor 3 (intestinal)	C00001226
7082	TJP1, ZO-1	tight junction protein 1	C00001226
7124	TNF, DIF, TNF-alpha, TNFA, TNFSF2	tumor necrosis factor	C00001226
7295	TXN, TRDX, TRX, TRX1	thioredoxin	C00001226
7296	TXNRD1, GRIM-12, TR, TR1, TRXR1, TXNR	thioredoxin reductase 1 (EC:1.8.1.9)	C00001226

Related Diseases

Diseases related to proteins in ChEMBL interactions