KCF-S cluster No. 36 (89 metabolites)

Corresponding Phytochemical cluster No. 13

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (89)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

---

Cumulative plant class count

class name	count
asterids	114
rosids	112
Spermatophyta	29
eudicotyledons	26
Liliopsida	11
Magnoliophyta	2
Embryophyta	2

---

Cumulative family count (Top 20)

class name	count
Asteraceae	72
Myrtaceae	37
Fabaceae	31
Pinaceae	25
Polygonaceae	18
Ericaceae	15
Rosaceae	14
Plantaginaceae	7
Gesneriaceae	6
Vitaceae	5
Fagaceae	5
Gnetaceae	4
Salicaceae	4
Melanthiaceae	4
Acanthaceae	4
Symplocaceae	4
Dipterocarpaceae	3
Adoxaceae	3
Ricciaceae	2
Hypericaceae	2

KEGG BRITE br08003

---

Categories (4)

br08003 Category	# of metabolite
Dihydrochalcones	2
Stilbenes	4
Chalcones	2
Aurones	1

---

metabolites link (9)

br08003 Category	KEGG ID	KNApSAcK ID
Dihydrochalcones	C09754	C00000967
Dihydrochalcones	C01604	C00000990
Stilbenes	C10245	C00002870
Stilbenes	C10266	C00002887
Stilbenes	C10275	C00002896
Stilbenes	C10288	C00002904
Chalcones	C16407	C00007882
Chalcones	C16408	C00007915
Aurones	C16409	C00008046

Metabolite list (89)

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
C00000967	Glycyphyllin
C00000990	Phloridzin / Phloretin 2'-glucoside	CHEMBL45266 CHEMBL245067 CHEMBL1320052 CHEMBL1524370 CHEMBL2096900	D010695	16 / 15 / 14	3 / 7
C00002870	Astringin / (E)-Astringin / 3,4,3',5'-Tetrahydroxystilbene 3'-glucoside	CHEMBL358769 CHEMBL469920
C00002887	Isorhapontigenin 3-O-beta-D-glucopyranoside	CHEMBL113339
C00002896	Piceid / Resveratrol 3-O-beta-glucopyranoside / 3,3',4,5'-Tetrahydroxystilbene 3-O-beta-D-glucopyranoside	CHEMBL142652 CHEMBL509386 CHEMBL597338 CHEMBL1990895		7 / 6 / 4
C00002904	Rhaponthin / Rhaponticin / 4'-Methoxy-3,3',5-trihydroxystilbene 3-O-beta-D-glucopyranoside	CHEMBL109266 CHEMBL1987358	C023538
C00007177	4,2',4'-Trihydroxy-6'-methoxychalcone 4-glucoside
C00007178	Rocymosin B
C00007181	4'-Hydroxychalcone 4'-glucoside
C00007183	4,2'-Dihydroxychalcone 4-glucoside
C00007184	Isoliquiritin	CHEMBL599763		1 / 0 / 0
C00007185	Neoisoliquiritin / Neoisoliquiritigenin
C00007189	Monospermoside
C00007218	Coreopsin
C00007221	Homobutein 4-glucoside
C00007878	Chalconaringenin 4-glucoside
C00007880	Chalconaringenin 2'-xyloside
C00007881	Isosalipurposide	CHEMBL2029165	C027321	1 / 1 / 1	0 / 2
C00007882	Chalconaringenin 4'-glucoside
C00007885	Neosakuranin	CHEMBL495848
C00007886	Helichrysin		C009562
C00007888	4,2'-Dihydroxy-4',6'-dimethoxychalcone 4-glucoside
C00007890	2',4',6',beta-Tetrahydroxychalcone 2'-glucoside
C00007891	2',4',6',beta-Tetrahydroxychalcone 4'-glucoside
C00007892	Okanin 3'-glucoside
C00007893	Marein	CHEMBL490510		6 / 5 / 13
C00007894	Okanin 4'-(6''-acetylglucoside)
C00007904	Okanin 4-methyl ether 3'-glucoside
C00007905	Okanin 4-methyl ether 3'-(6''-acetylglucoside)
C00007906	Okanin 4-methyl ether 4'-glucoside
C00007907	Okanin 4-methyl ether 4'-(6''-acetylglucoside)
C00007909	Lanceolin
C00007910	Okanin 3,4-dimethyl ehter 4'-glucoside
C00007911	Okanin 3,4,3'-trimethyl ether 4'-glucoside
C00007913	Stillopsin
C00007914	3,4,2',4',6'-Pentahydroxychalcone 2'-glucoside
C00007915	3,4,2',4',6'-Pentahydroxychalcone 4'-glucoside
C00007916	Homoeriodictyolchalcone 2'-glucoside
C00007917	4,2'-Dihydroxy-3,4',6'-trimethoxychalcone 4-glucoside
C00007918	3,4,5,2',4',6'-Hexahydroxychalcone 2'-glucoside
C00007919	3,4,2',4',6',beta-Hexahydroxychalcone 2'-glucoside
C00007920	3,4,2',3',4',6',alpha-Heptahydroxychalcone 2'-glucoside
C00007988	Davidioside
C00007989	Confusoside	CHEMBL1084916
C00007990	4'-O-Methyldavidioside
C00007991	Trilobatin	CHEMBL514177		1 / 0 / 0
C00007992	Asebotin	CHEMBL490513	C002548
C00007993	Sieboldin
C00008041	Hispidol 6-glucoside
C00008042	4,6,4'-Trihydroxyaurone 6-rhamnoside
C00008043	Sulfurein	CHEMBL491695
C00008045	Cernuoside
C00008046	Aureusin
C00008047	Aureusidin 6-rhamnoside
C00008050	Maritimein	CHEMBL1454040 CHEMBL2165570		8 / 3 / 7
C00008055	Maritimetin 7-glucoside
C00008056	Leptosin
C00008059	Bractein	CHEMBL1972687
C00008060	Bracteatin 6-glucoside
C00008064	6,4'-Dihydroxy-7-methylaurone 6-rhamnoside
C00008065	4,6,4'-Trihydroxy-7-methylaurone 4-rhamnoside
C00014494	4,2',3'-Trihydroxychalcone 4-O-glucoside
C00014503	Androechin / 2,2',6'-Trihydroxy-4'-methoxychalcone 2'-O-glucoside
C00014508	Homobutein 4'-O-glucoside / 4,2',4'-Trihydroxy-3-methoxychalcone 4'-O-glucoside
C00014514	2',4',4-Trihydroxy-3',3-dimethoxychalcone 4'-O-glucoside
C00014515	4,6,2',4'-Tetramethoxychalcone 2'-beta-glucoside
C00014628	Phloretin 2'-O-(6''-O-acetylglucoside) / 4,2',4',6'-Tetrahydroxydihydroxychalcone 2'-O-(6''-O-acetylglucoside)
C00014629	Phloretin 2'-O-(2''-O-Acetylglucoside) / 4,2',4',6'-Tetrahydroxydihydroxychalcone 2'-O-(2''-O-Acetylglucoside)
C00014631	4-Methoxyphlorizin / 2',4',6'-Trihydroxy-4-methoxydihydrochalcone 2'-O-glucoside	CHEMBL2303988		1 / 1 / 1
C00014632	Zosterin / 4,2'-Dihydroxy-4',6'-diacetoxydihydrochalcone 2'-O-glucoside
C00014634	Licoagroside F / 4,2',4',alpha-Tetrahydroxydihydrochalcone alpha-O-glucoside
C00015300	Resveratroloside / Resveratrol 4'-O-beta-D-glucopyranoside / 3,4',5-Trihydroxystilbene 4'-O-beta-D-glucopyranoside	CHEMBL478753 CHEMBL476674
C00015395	3,5-Dihydroxy-4'-methoxystilbene 3-O-beta-D-glucopyranoside	CHEMBL113536 CHEMBL464004 CHEMBL1513359 CHEMBL1863546		3 / 4 / 2
C00015566	4'-Methoxy-3,3',5-trihydroxystilbene 3'-O-beta-D-glucopyranoside
C00015568	5,3',4'-Trihydroxybibenzyl 2-O-beta-D-glucopyranoside
C00015584	5,4'-Dihydroxybibenzyl 2-O-beta-D-glucopyranoside
C00015772	Gnetifolin E / Isorhapontigenin 12-beta-D-glucoside	CHEMBL1083413
C00015893	2,3,4',5-Tetrahydroxystilbene 2-O-beta-D-glucopyranoside	CHEMBL460860
C00019240	Oxyresveratrol 2-O-beta-glucopyranoside
C00019241	Oxyresveratrol 3'-O-beta-glucopyranoside
C00030976	Phalerin
C00036732	Annulatophenonoside / (-)-Annulatophenonoside
C00037289	Hypericophenonoside / (+)-Hypericophenonoside
C00037422	Lindleyin		C018585
C00041895	Stilbostemin B 3'-beta-D-glucopyranoside / (-)-Stilbostemin B 3'-beta-D-glucopyranoside	CHEMBL495642
C00041896	Stilbostemin H 3'-beta-D-glucopyranoside / (-)-Stilbostemin H 3'-beta-D-glucopyranoside	CHEMBL495844
C00042128	3-Hydroxyasebotin / (-)-3-Hydroxyasebotin	CHEMBL480475
C00042535	Garcimangosone D / (-)-Garcimangosone D
C00047562	Scorzodihydrostilbene C	CHEMBL556267

Human Protein / Gene in interactions

35 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
P13866	Sodium/glucose cotransporter 1	Glucose	C00000990 C00007881 C00014631	1 / 1
P27695	DNA-(apurinic or apyrimidinic site) lyase	Enzyme	C00002896 C00007893 C00008050	0 / 0
P10636	Microtubule-associated protein tau	Unclassified protein	C00000990 C00002896	4 / 3
Q9UBT6	DNA polymerase kappa	Enzyme	C00007893 C00008050	0 / 0
P10253	Lysosomal alpha-glucosidase	Hydrolase	C00002896 C00007893	1 / 1
B2RXH2	Lysine-specific demethylase 4E	Enzyme	C00000990 C00002896	0 / 0
Q9HAS3	Solute carrier family 28 member 3	Unclassified protein	C00000990 C00007991	0 / 0
P38398	Breast cancer type 1 susceptibility protein	Enzyme	C00015395	4 / 2
P10828	Thyroid hormone receptor beta	NR1A2	C00000990	3 / 1
P11712	Cytochrome P450 2C9	Cytochrome P450 2C9	C00000990	0 / 1
Q9NR56	Muscleblind-like protein 1	Unclassified protein	C00002896	1 / 0
P00533	Epidermal growth factor receptor	TK tyrosine-protein kinase EGFR subfamily	C00007893	1 / 8
P11473	Vitamin D3 receptor	NR1I1	C00007893	2 / 3
P39748	Flap endonuclease 1	Enzyme	C00008050	0 / 0
Q92830	Histone acetyltransferase KAT2A	Enzyme	C00000990	0 / 0
O75496	Geminin	Unclassified protein	C00015395	0 / 0
Q9NY91	Low affinity sodium-glucose cotransporter	Unclassified protein	C00000990	0 / 0
Q99808	Equilibrative nucleoside transporter 1	Nucleoside uniporter	C00000990	0 / 0
P15121	Aldose reductase	Enzyme	C00007184	0 / 0
P43220	Glucagon-like peptide 1 receptor	Glucagon-like peptide receptor	C00015395	0 / 0
P28482	Mitogen-activated protein kinase 1	Erk	C00002896	0 / 0
Q99714	3-hydroxyacyl-CoA dehydrogenase type-2	Enzyme	C00000990	3 / 3
P15428	15-hydroxyprostaglandin dehydrogenase [NAD(+)]	Enzyme	C00000990	2 / 2
P33261	Cytochrome P450 2C19	Cytochrome P450 2C19	C00000990	1 / 1
P08684	Cytochrome P450 3A4	Cytochrome P450 3A4	C00000990	0 / 1
Q9UNA4	DNA polymerase iota	Enzyme	C00008050	0 / 0
O75164	Lysine-specific demethylase 4A	Enzyme	C00008050	0 / 0
Q13526	Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1	Enzyme	C00008050	0 / 0
P06746	DNA polymerase beta	Enzyme	C00002896	0 / 0
O00337	Sodium/nucleoside cotransporter 1	Unclassified protein	C00000990	0 / 0
O43868	Sodium/nucleoside cotransporter 2	Unclassified protein	C00000990	0 / 0
P31639	Sodium/glucose cotransporter 2	Glucose	C00000990	1 / 1
Q9NUW8	Tyrosyl-DNA phosphodiesterase 1	Enzyme	C00007893	1 / 1
O00255	Menin	Unclassified protein	C00008050	2 / 5
Q03164	Histone-lysine N-methyltransferase 2A	Enzyme	C00008050	1 / 2

3 Gene in CTD interactions

gene	gene name	gene description	KNApSAcK metabolite in interactions
213	ALB, PRO0883, PRO0903, PRO1341	albumin	C00000990
4846	NOS3, ECNOS, eNOS	nitric oxide synthase 3 (endothelial cell) (EC:1.14.13.39)	C00000990
6523	SLC5A1, D22S675, NAGT, SGLT1	solute carrier family 5 (sodium/glucose cotransporter), member 1	C00000990

Related Diseases

Diseases related to proteins in ChEMBL interactions

Diseases related to CTD interactions