phytochemical cluster No. 40 (58 metabolites)

• Index
• Plant Species
• KEGG BRITE br08003
• KCF-S cluster (5)
• Metabolite list (58)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

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Cumulative plant class count

class name	count
asterids	73
Spermatophyta	67
rosids	1

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Cumulative family count

class name	count
Lamiaceae	67
Cupressaceae	43
Pinaceae	16
Scrophulariaceae	4
Podocarpaceae	4
Araucariaceae	2
Asteraceae	2
Taxaceae	2
Celastraceae	1

KEGG BRITE br08003

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Categories (1)

br08003 Category	# of metabolite
Abietanes	7

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metabolites link (7)

br08003 Category	KEGG ID	KNApSAcK ID
Abietanes	C11878	C00000868
Abietanes	C06087	C00000871
Abietanes	C09069	C00003410
Abietanes	C09092	C00003426
Abietanes	C09182	C00003480
Abietanes	C09194	C00003488
Abietanes	C09196	C00003489

KCF-S cluster (5)

KCF-S ID	# of metabolite
No. 359	20
No. 734	11
No. 792	11
No. 1020	9
No. 1536	7

Metabolite list (58)

KNApSAcK ID	name	ChEMBL link	CTD link	# of proteins in ChEMBL interaction / related OMIM / related KEGG DISEASE	# of genes in CTD interaction / related diseases	KCF-S cluster	figure
C00049757	4-epi-abietic acid	CHEMBL71893 CHEMBL1336124 CHEMBL1357151 CHEMBL1514489 CHEMBL1552001		18 / 22 / 25		No. 359
C00038150	Viridinol / (+)-Viridinol					No. 359
C00048933	Abietal / 7,13-Abietadien-18-al / Abieta-7,13-diene-18-al	CHEMBL563793				No. 359
C00044421	Abietol / Abietinol / Abieta-7,13-diene-18-ol	CHEMBL304954 CHEMBL1436063	C026490	9 / 12 / 10		No. 359
C00040023	3-Oxo-isotaxodione / (-)-3-Oxo-isotaxodione					No. 359
C00034167	Sugikurojin D / (+)-Sugikurojin D					No. 359
C00003426	Pisiferal / (+)-Pisiferal					No. 359
C00032365	Rosmadial / (-)-Rosmadial	CHEMBL494864				No. 359
C00040508	ent-Abieta-7,13-diene					No. 359
C00040276	Abieta-7,13-diene					No. 359
C00040024	Taxodione	CHEMBL235195	C009387			No. 359
C00039446	6,7-Dehydroroyleanone	CHEMBL242491	C043551			No. 359
C00031045	12-O-Methylisohinokiol					No. 359
C00038205	12-Deoxy-6,7-dehydroroyleanone					No. 359
C00038153	12-Deoxy-6-hydroxy-6,7-dehydroroyleanone					No. 359
C00035987	Rosmanol					No. 359
C00036109	Taiwaniaquinone C					No. 359
C00038152	Taxodone					No. 359
C00031522	Salvicanol					No. 359
C00031278	Triptobenzene L / (+)-Triptobenzene L					No. 359
C00032255	20-Acetoxypisiferol					No. 734
C00031517	Pisiferanol / (+)-Pisiferanol					No. 734
C00031495	12-O-Methylpisiferanol					No. 734
C00031191	Isohinokiol	CHEMBL1277661				No. 734
C00031190	Totaradiol / 3beta-Hydroxytotarol	CHEMBL446064				No. 734
C00030193	12-Methylferruginol / 12-O-Methylferruginol / (+)-12-Methylferruginol / (+)-12-O-Methylferruginol	CHEMBL226233 CHEMBL226235		1 / 2 / 2		No. 734
C00036208	Taiwaniaquinone E / (-)-Taiwaniaquinone E	CHEMBL1088482				No. 734
C00003410	16-Hydroxy-ferruginol / (+)-16-Hydroxy-ferruginol					No. 734
C00041292	Abietadiene					No. 734
C00037344	6beta,7alpha-Diacetoxyroyleanone / (-)-6beta,7alpha-Diacetoxyroyleanone					No. 734
C00032256	Epirosmanol	CHEMBL507166				No. 734
C00032282	12,16-Epoxycarnosol	CHEMBL1079367				No. 792
C00032281	16-Hydroxycarnosol	CHEMBL491307				No. 792
C00036020	Horminone / 7alpha-Hydroxyroyleanone	CHEMBL517846 CHEMBL1969546	C045490			No. 792
C00032279	Carnosol	CHEMBL218693 CHEMBL1514916	C068623	17 / 17 / 17	12 / 0	No. 792
C00032278	7-Methoxyrosmanol / (+)-7-Methoxyrosmanol	CHEMBL464376 CHEMBL1081338				No. 792
C00032277	Isorosmanol	CHEMBL494659 CHEMBL2333536				No. 792
C00036123	Taiwaniaquinone F / (-)-Taiwaniaquinone F	CHEMBL1088627				No. 792
C00003480	Totarol / (+)-Totarol	CHEMBL487602 CHEMBL1474684 CHEMBL1999971	C078548	20 / 19 / 47		No. 792
C00048934	Abietic acid / 7,13-Abietadien-18-oic acid	CHEMBL71893 CHEMBL1336124 CHEMBL1357151 CHEMBL1514489 CHEMBL1552001	C023710	18 / 22 / 25		No. 792
C00036922	Columbaridione					No. 792
C00035958	Salviviridinol					No. 792
C00038137	Deoxybuddlejone	CHEMBL506233				No. 1020
C00038138	Buddlejone / (-)-Buddlejone	CHEMBL487591				No. 1020
C00036242	7-Acetylhorminone / 7alpha-Acetoxyroyleanone	CHEMBL516119				No. 1020
C00036112	Taiwaniaquinone A	CHEMBL1087802				No. 1020
C00036069	Taiwaniaquinone B					No. 1020
C00036017	Royleanone	CHEMBL1813341				No. 1020
C00003488	Pomiferin A / (+)-Pomiferin A / 18-Hydroxy-dehydroabietane	CHEMBL12799				No. 1020
C00035940	Sugikurojin E / (+)-Sugikurojin E					No. 1020
C00003489	bietatriene / Dehydroabietane / Abieta-8,11,13-triene					No. 1020
C00007631	Dehydroabietinal	CHEMBL1080038				No. 1536
C00036013	19-Hydroxy-royleanone					No. 1536
C00000878	Ferruginol	CHEMBL197308				No. 1536
C00000871	Sempervirol	CHEMBL1097038				No. 1536
C00000870	Pisiferol	CHEMBL193987				No. 1536
C00000869	12-Hydroxydehydroabietinol	CHEMBL197310				No. 1536
C00000868	19-Hydroxyferruginol	CHEMBL197310				No. 1536

Human Protein / Gene in interactions

44 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
O94782	Ubiquitin carboxyl-terminal hydrolase 1	Enzyme	C00000870 C00000871 C00036013 C00040508	0 / 0
Q15118	[Pyruvate dehydrogenase [lipoamide]] kinase isozyme 1, mitochondrial	Pdhk	C00000870 C00000871 C00036013	0 / 0
Q15120	[Pyruvate dehydrogenase [lipoamide]] kinase isozyme 3, mitochondrial	Pdhk	C00000870 C00000871 C00036013	1 / 0
P08684	Cytochrome P450 3A4	Cytochrome P450 3A4	C00000871 C00036013 C00040508	0 / 1
Q15119	[Pyruvate dehydrogenase [lipoamide]] kinase isozyme 2, mitochondrial	Pdhk	C00000870 C00000871 C00036013	0 / 0
Q16654	[Pyruvate dehydrogenase [lipoamide]] kinase isozyme 4, mitochondrial	Pdhk	C00000870 C00000871 C00036013	0 / 0
P16050	Arachidonate 15-lipoxygenase	Enzyme	C00000870 C00000871 C00036013	0 / 0
P02545	Prelamin-A/C	Unclassified protein	C00000870 C00000871 C00036013	11 / 10
P10636	Microtubule-associated protein tau	Unclassified protein	C00000871 C00036013 C00040508	4 / 3
B2RXH2	Lysine-specific demethylase 4E	Enzyme	C00000871 C00036013 C00040508	0 / 0
P11473	Vitamin D3 receptor	NR1I1	C00000871 C00003410 C00036013	2 / 3
P00352	Retinal dehydrogenase 1	Enzyme	C00000870 C00000871 C00036013	0 / 0
Q96KQ7	Histone-lysine N-methyltransferase EHMT2	Enzyme	C00000871 C00003410 C00036013	0 / 0
O00255	Menin	Unclassified protein	C00003410 C00040508	2 / 5
P11712	Cytochrome P450 2C9	Cytochrome P450 2C9	C00000871 C00036013	0 / 1
P84022	Mothers against decapentaplegic homolog 3	Unclassified protein	C00003410 C00040508	2 / 0
O75496	Geminin	Unclassified protein	C00003410 C00040508	0 / 0
Q03164	Histone-lysine N-methyltransferase 2A	Enzyme	C00003410 C00040508	1 / 2
O75164	Lysine-specific demethylase 4A	Enzyme	C00003410 C00040508	0 / 0
P35354	Prostaglandin G/H synthase 2	Oxidoreductase	C00000871 C00036013	0 / 3
P33261	Cytochrome P450 2C19	Cytochrome P450 2C19	C00000871 C00036013	1 / 1
Q99700	Ataxin-2	Unclassified protein	C00003410 C00040508	1 / 1
O94925	Glutaminase kidney isoform, mitochondrial	Enzyme	C00000871 C00036013	0 / 0
P28482	Mitogen-activated protein kinase 1	Erk	C00000870 C00040508	0 / 0
Q99714	3-hydroxyacyl-CoA dehydrogenase type-2	Enzyme	C00000871 C00036013	3 / 3
P11511	Cytochrome P450 19A1	Cytochrome P450 19A1	C00038150	2 / 2
Q9HC16	DNA dC->dU-editing enzyme APOBEC-3G	Enzyme	C00003410	0 / 0
P83916	Chromobox protein homolog 1	Unclassified protein	C00003410	0 / 0
P43220	Glucagon-like peptide 1 receptor	Glucagon-like peptide receptor	C00040508	0 / 0
P16233	Pancreatic triacylglycerol lipase	Hydrolase	C00003410	0 / 0
Q16236	Nuclear factor erythroid 2-related factor 2	Unclassified protein	C00040508	0 / 0
P07900	Heat shock protein HSP 90-alpha	Other cytosolic protein	C00040508	0 / 0
Q9UBT6	DNA polymerase kappa	Enzyme	C00040508	0 / 0
P11413	Glucose-6-phosphate 1-dehydrogenase	Enzyme	C00003410	1 / 2
Q92830	Histone acetyltransferase KAT2A	Enzyme	C00003410	0 / 0
O75874	Isocitrate dehydrogenase [NADP] cytoplasmic	Enzyme	C00040508	1 / 0
P39748	Flap endonuclease 1	Enzyme	C00003410	0 / 0
P37840	Alpha-synuclein	Unclassified protein	C00003410	4 / 2
O75604	Ubiquitin carboxyl-terminal hydrolase 2	Enzyme	C00040508	0 / 0
Q9Y5X4	Photoreceptor-specific nuclear receptor	NR2E3	C00003410	2 / 2
Q13526	Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1	Enzyme	C00040508	0 / 0
P49798	Regulator of G-protein signaling 4	Unclassified protein	C00003410	2 / 0
P04637	Cellular tumor antigen p53	Transcription Factor	C00040508	7 / 37
Q13148	TAR DNA-binding protein 43	Unclassified protein	C00040508	1 / 1

12 Gene in CTD interactions

gene	gene name	gene description	KNApSAcK metabolite in interactions
196	AHR, bHLHe76	aryl hydrocarbon receptor	C00003410
1543	CYP1A1, AHH, AHRR, CP11, CYP1, P1-450, P450-C, P450DX	cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1)	C00003410
1545	CYP1B1, CP1B, CYPIB1, GLC3A, P4501B1	cytochrome P450, family 1, subfamily B, polypeptide 1 (EC:1.14.14.1)	C00003410
2729	GCLC, GCL, GCS, GLCL, GLCLC	glutamate-cysteine ligase, catalytic subunit (EC:6.3.2.2)	C00003410
2730	GCLM, GLCLR	glutamate-cysteine ligase, modifier subunit (EC:6.3.2.2)	C00003410
3162	HMOX1, HMOX1D, HO-1, HSP32, bK286B10	heme oxygenase (decycling) 1 (EC:1.14.99.3)	C00003410
3383	ICAM1, BB2, CD54, P3.58	intercellular adhesion molecule 1	C00003410
3551	IKBKB, IKK-beta, IKK2, IKKB, NFKBIKB	inhibitor of kappa light polypeptide gene enhancer in B-cells, kinase beta (EC:2.7.11.10)	C00003410
4780	NFE2L2, NRF2	nuclear factor, erythroid 2-like 2	C00003410
4792	NFKBIA, IKBA, MAD-3, NFKBI	nuclear factor of kappa light polypeptide gene enhancer in B-cells inhibitor, alpha	C00003410
5970	RELA, NFKB3, p65	v-rel avian reticuloendotheliosis viral oncogene homolog A	C00003410
7124	TNF, DIF, TNF-alpha, TNFA, TNFSF2	tumor necrosis factor	C00003410

Related Diseases

Diseases related to proteins in ChEMBL interactions