KCF-S cluster No. 227 (27 metabolites)

Corresponding Phytochemical cluster No. 38

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (27)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

---

Cumulative plant class count

class name	count
asterids	46
Magnoliophyta	6

---

Cumulative family count

class name	count
Asteraceae	46
Magnoliaceae	6

KEGG BRITE br08003

---

Categories (1)

br08003 Category	# of metabolite
Germacrenes	2

---

metabolites link (2)

br08003 Category	KEGG ID	KNApSAcK ID
Germacrenes	C09349	C00003224
Germacrenes	C07609	C00003345

Metabolite list (27)

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
C00003224	Baileyin
C00003345	Parthenolide	CHEMBL363656 CHEMBL477923 CHEMBL388727 CHEMBL465158 CHEMBL540445 CHEMBL1356390 CHEMBL1527933 CHEMBL1601875 CHEMBL1881731 CHEMBL2142363 CHEMBL2357484		123 / 80 / 85
C00012096	Peroxyparthenolide
C00012100	Stizolin / Stizoline / 8alpha-Hydroxyparthenolide
C00012106	9alpha-Hydroxyparthenolide	CHEMBL464587 CHEMBL462949 CHEMBL1969868 CHEMBL1990954 CHEMBL1993813
C00012109	Melampomagnolide B	CHEMBL563939 CHEMBL1672878
C00012120	Anhydroverlotorin-4alpha,5beta-epoxide
C00012344	Quadrangolide
C00012345	4alpha,5beta-Epoxy-8-epi-inunolide
C00012361	Simsiolide
C00012362	Speciformin / Spiciformin
C00012363	Purpurascenolide
C00012394	Tanargyrolide
C00020604	1,8-Epoxyosmitopisn
C00020606	Estafiatin
C00020621	[3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-3a,4,5,7,7a,8a,8b,8c-Octahydro-7-hydroxy-6,8a-dimethyl-3-methylene-oxireno[2,3]azuleno[4,5-b]furan-2(3H)-one
C00020626	[3aS-(3aalpha,7beta,7aalpha,8aalpha,8balpha,8cbeta)]-3a,4,5,7,7a,8a,8b,8c-Octahydro-7-hydroxy-6,8a-dimethyl-3-methylene-oxireno[2,3]azuleno[4,5-b]furan-2(3H)-one
C00021704	4beta,5alpha-Epoxy-4,5-cis-inunolide
C00021706	1beta,10alpha-Epoxy-1,10-H-cis-inunolide
C00033960	Isospiciformin
C00037436	Ludartin
C00042486	Eminensin A	CHEMBL191096 CHEMBL1725046 CHEMBL1985272		15 / 7 / 8
C00045198	9beta-Hydroxyparthenolide	CHEMBL464587 CHEMBL462949 CHEMBL1969868 CHEMBL1990954 CHEMBL1993813
C00045593	8-Desoxy-3alpha,4alpha-epoxyrupiculin A / (-)-8-Desoxy-3alpha,4alpha-epoxyrupiculin A	CHEMBL462670
C00046169	Moroccolide A / (+)-Moroccolide A	CHEMBL462669
C00046365	Saharanolide A / (-)-Saharanolide A	CHEMBL459916
C00046844	Parthenolid-9-one / (-)-Parthenolid-9-one	CHEMBL479474 CHEMBL519106

Human Protein / Gene in interactions

128 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
Q99700	Ataxin-2	Unclassified protein	C00003345 C00042486	1 / 1
Q00653	Nuclear factor NF-kappa-B p100 subunit	Transcription Factor	C00003345 C00042486	0 / 0
O75874	Isocitrate dehydrogenase [NADP] cytoplasmic	Enzyme	C00003345 C00042486	1 / 0
Q16236	Nuclear factor erythroid 2-related factor 2	Unclassified protein	C00003345 C00042486	0 / 0
P19838	Nuclear factor NF-kappa-B p105 subunit	Transcription Factor	C00003345 C00042486	0 / 0
P83916	Chromobox protein homolog 1	Unclassified protein	C00003345 C00042486	0 / 0
Q04206	Transcription factor p65	Transcription Factor	C00003345 C00042486	0 / 0
O75496	Geminin	Unclassified protein	C00003345 C00042486	0 / 0
P84022	Mothers against decapentaplegic homolog 3	Unclassified protein	C00003345 C00042486	2 / 0
P11473	Vitamin D3 receptor	NR1I1	C00003345 C00042486	2 / 3
P28335	5-hydroxytryptamine receptor 2C	Serotonin receptor	C00003345	0 / 0
P49146	Neuropeptide Y receptor type 2	Neuropeptide Y receptor	C00003345	0 / 0
P29466	Caspase-1	C14	C00003345	0 / 0
P17252	Protein kinase C alpha type	Alpha	C00003345	0 / 0
P27361	Mitogen-activated protein kinase 3	Erk	C00003345	0 / 0
P14780	Matrix metalloproteinase-9	M10A	C00003345	2 / 2
P02545	Prelamin-A/C	Unclassified protein	C00003345	11 / 10
P16473	Thyrotropin receptor	Glycohormone receptor	C00003345	3 / 2
P00918	Carbonic anhydrase 2	Lyase	C00003345	1 / 2
P07550	Beta-2 adrenergic receptor	Adrenergic receptor	C00003345	0 / 1
P21397	Amine oxidase [flavin-containing] A	Oxidoreductase	C00003345	1 / 1
P25021	Histamine H2 receptor	Histamine receptor	C00003345	0 / 0
P35367	Histamine H1 receptor	Histamine receptor	C00003345	0 / 0
Q01959	Sodium-dependent dopamine transporter	Dopamine	C00003345	1 / 0
P08912	Muscarinic acetylcholine receptor M5	Acetylcholine receptor	C00003345	0 / 0
P18825	Alpha-2C adrenergic receptor	Adrenergic receptor	C00003345	0 / 0
P13945	Beta-3 adrenergic receptor	Adrenergic receptor	C00003345	0 / 0
P25024	C-X-C chemokine receptor type 1	CXC chemokine receptor	C00003345	0 / 0
P06241	Tyrosine-protein kinase Fyn	Src	C00003345	0 / 0
Q08209	Serine/threonine-protein phosphatase 2B catalytic subunit alpha isoform	Ser_Thr	C00003345	0 / 0
P11712	Cytochrome P450 2C9	Cytochrome P450 2C9	C00003345	0 / 1
P00533	Epidermal growth factor receptor	TK tyrosine-protein kinase EGFR subfamily	C00003345	1 / 8
P33765	Adenosine receptor A3	Adenosine receptor	C00003345	0 / 0
P14416	D(2) dopamine receptor	Dopamine receptor	C00003345	2 / 0
P23219	Prostaglandin G/H synthase 1	Oxidoreductase	C00003345	0 / 0
P37288	Vasopressin V1a receptor	Vasopressin and oxytocin receptor	C00003345	0 / 0
P41145	Kappa-type opioid receptor	Opioid receptor	C00003345	0 / 0
Q9Y271	Cysteinyl leukotriene receptor 1	Leukotriene receptor	C00003345	0 / 0
P29274	Adenosine receptor A2a	Adenosine receptor	C00003345	0 / 0
P25929	Neuropeptide Y receptor type 1	Neuropeptide Y receptor	C00003345	0 / 0
P50052	Type-2 angiotensin II receptor	Angiotensin receptor	C00003345	1 / 1
P17948	Vascular endothelial growth factor receptor 1	Vegfr	C00003345	0 / 0
P41968	Melanocortin receptor 3	Melanocortin receptor	C00003345	1 / 0
P00352	Retinal dehydrogenase 1	Enzyme	C00003345	0 / 0
P11509	Cytochrome P450 2A6	Cytochrome P450 2A6	C00003345	0 / 0
Q16665	Hypoxia-inducible factor 1-alpha	Transcription Factor	C00003345	0 / 0
P42858	Huntingtin	Unclassified protein	C00003345	1 / 1
P08246	Neutrophil elastase	S1A	C00003345	2 / 1
Q12809	Potassium voltage-gated channel subfamily H member 2	KCNH, Kv10-12.x (Ether-a-go-go)	C00003345	2 / 2
P51151	Ras-related protein Rab-9A	Unclassified protein	C00003345	0 / 0
P04035	3-hydroxy-3-methylglutaryl-coenzyme A reductase	Oxidoreductase	C00003345	0 / 0
P08913	Alpha-2A adrenergic receptor	Adrenergic receptor	C00003345	0 / 0
P21917	D(4) dopamine receptor	Dopamine receptor	C00003345	0 / 0
P30988	Calcitonin receptor	Calcitonin receptor	C00003345	0 / 0
P35462	D(3) dopamine receptor	Dopamine receptor	C00003345	1 / 0
P41143	Delta-type opioid receptor	Opioid receptor	C00003345	0 / 0
Q92731	Estrogen receptor beta	NR3A2	C00003345	0 / 1
P41595	5-hydroxytryptamine receptor 2B	Serotonin receptor	C00003345	0 / 0
P25101	Endothelin-1 receptor	Endothelin receptor	C00003345	0 / 0
P30411	B2 bradykinin receptor	Bradykinin receptor	C00003345	0 / 0
P32245	Melanocortin receptor 4	Melanocortin receptor	C00003345	1 / 0
P32238	Cholecystokinin receptor type A	Cholecystokinin receptor	C00003345	0 / 0
P08311	Cathepsin G	S1A	C00003345	0 / 0
Q99720	Sigma non-opioid intracellular receptor 1	Membrane receptor	C00003345	1 / 0
P43220	Glucagon-like peptide 1 receptor	Glucagon-like peptide receptor	C00042486	0 / 0
P03956	Interstitial collagenase	M10A	C00003345	0 / 1
P32241	Vasoactive intestinal polypeptide receptor 1	Vasoactive intestinal peptide receptor	C00003345	0 / 0
P35354	Prostaglandin G/H synthase 2	Oxidoreductase	C00003345	0 / 3
Q9Y253	DNA polymerase eta	Enzyme	C00042486	1 / 1
P42226	Signal transducer and activator of transcription 6	Unclassified protein	C00003345	0 / 0
P21728	D(1A) dopamine receptor	Dopamine receptor	C00003345	0 / 0
Q9HC16	DNA dC->dU-editing enzyme APOBEC-3G	Enzyme	C00042486	0 / 0
P11021	78 kDa glucose-regulated protein	Unclassified protein	C00003345	0 / 0
P04150	Glucocorticoid receptor	NR3C1	C00003345	0 / 1
P08172	Muscarinic acetylcholine receptor M2	Acetylcholine receptor	C00003345	2 / 0
P11229	Muscarinic acetylcholine receptor M1	Acetylcholine receptor	C00003345	0 / 0
P21554	Cannabinoid receptor 1	Cannabinoid receptor	C00003345	0 / 0
P31645	Sodium-dependent serotonin transporter	Serotonin	C00003345	2 / 0
P04626	Receptor tyrosine-protein kinase erbB-2	TK tyrosine-protein kinase EGFR subfamily	C00003345	5 / 9
P20309	Muscarinic acetylcholine receptor M3	Acetylcholine receptor	C00003345	1 / 0
P21452	Substance-K receptor	Neurokinin receptor	C00003345	0 / 0
P51679	C-C chemokine receptor type 4	CC chemokine receptor	C00003345	0 / 0
P51681	C-C chemokine receptor type 5	CC chemokine receptor	C00003345	3 / 0
P50406	5-hydroxytryptamine receptor 6	Serotonin receptor	C00003345	0 / 0
P41597	C-C chemokine receptor type 2	CC chemokine receptor	C00003345	1 / 0
P28482	Mitogen-activated protein kinase 1	Erk	C00003345	0 / 0
P08575	Receptor-type tyrosine-protein phosphatase C	Enzyme	C00003345	2 / 1
P05177	Cytochrome P450 1A2	Cytochrome P450 1A2	C00003345	0 / 0
O15118	Niemann-Pick C1 protein	Unclassified protein	C00003345	1 / 1
Q01453	Peripheral myelin protein 22	Unclassified protein	C00003345	5 / 2
Q96QE3	ATPase family AAA domain-containing protein 5	Unclassified protein	C00003345	0 / 0
O76074	cGMP-specific 3',5'-cyclic phosphodiesterase	PDE_5A	C00003345	0 / 0
P03372	Estrogen receptor	NR3A1	C00003345	1 / 1
P08588	Beta-1 adrenergic receptor	Adrenergic receptor	C00003345	1 / 0
P22303	Acetylcholinesterase	Hydrolase	C00003345	1 / 0
P28223	5-hydroxytryptamine receptor 2A	Serotonin receptor	C00003345	0 / 0
Q16539	Mitogen-activated protein kinase 14	p38	C00003345	0 / 0
P35372	Mu-type opioid receptor	Opioid receptor	C00003345	0 / 0
P08173	Muscarinic acetylcholine receptor M4	Acetylcholine receptor	C00003345	0 / 0
P25103	Substance-P receptor	Neurokinin receptor	C00003345	0 / 0
P25105	Platelet-activating factor receptor	PAF receptor	C00003345	0 / 0
P33032	Melanocortin receptor 5	Melanocortin receptor	C00003345	0 / 0
P49798	Regulator of G-protein signaling 4	Unclassified protein	C00003345	2 / 0
P33261	Cytochrome P450 2C19	Cytochrome P450 2C19	C00003345	1 / 1
P08684	Cytochrome P450 3A4	Cytochrome P450 3A4	C00003345	0 / 1
P05181	Cytochrome P450 2E1	Cytochrome P450 2E1	C00003345	0 / 0
Q9UNA4	DNA polymerase iota	Enzyme	C00042486	0 / 0
P10636	Microtubule-associated protein tau	Unclassified protein	C00003345	4 / 3
Q99549	M-phase phosphoprotein 8	Unclassified protein	C00003345	0 / 0
P10635	Cytochrome P450 2D6	Cytochrome P450 2D6	C00003345	1 / 0
P23975	Sodium-dependent noradrenaline transporter	Norepinephrine	C00003345	1 / 1
P25100	Alpha-1D adrenergic receptor	Adrenergic receptor	C00003345	0 / 0
P30542	Adenosine receptor A1	Adenosine receptor	C00003345	0 / 0
P18089	Alpha-2B adrenergic receptor	Adrenergic receptor	C00003345	0 / 0
P24557	Thromboxane-A synthase	Cytochrome P450 5A1	C00003345	1 / 1
P06239	Tyrosine-protein kinase Lck	Src	C00003345	0 / 1
P25025	C-X-C chemokine receptor type 2	CXC chemokine receptor	C00003345	0 / 0
Q9UBT6	DNA polymerase kappa	Enzyme	C00003345	0 / 0
P40225	Thrombopoietin	Unclassified protein	C00003345	1 / 1
Q96KQ7	Histone-lysine N-methyltransferase EHMT2	Enzyme	C00003345	0 / 0
P04637	Cellular tumor antigen p53	Transcription Factor	C00003345	7 / 37
O00255	Menin	Unclassified protein	C00003345	2 / 5
Q03164	Histone-lysine N-methyltransferase 2A	Enzyme	C00003345	1 / 2
Q13951	Core-binding factor subunit beta	Unclassified protein	C00003345	0 / 1
Q01196	Runt-related transcription factor 1	Unclassified protein	C00003345	1 / 4
P42345	Serine/threonine-protein kinase mTOR	Enzyme	C00003345	0 / 0
P01215	Glycoprotein hormones alpha chain	Unclassified protein	C00042486	0 / 3
Q13148	TAR DNA-binding protein 43	Unclassified protein	C00003345	1 / 1

Related Diseases

Diseases related to proteins in ChEMBL interactions