KCF-S cluster No. 3681 (3 metabolites)

Corresponding Phytochemical cluster No. 1

• Index
• Plant Species
• KEGG BRITE br08003
• Metabolite list (3)
• Human Protein
  / Gene in interactions
• Related Diseases

Plant Species

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Cumulative plant class count

class name	count
rosids	22
asterids	5
Magnoliophyta	1
Spermatophyta	1

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Cumulative family count

class name	count
Fabaceae	19
Styelidae	1
Enterobacteriaceae	1
Umbelopsidaceae	1
Lamiaceae	1
Begoniaceae	1
Lauraceae	1
Solanaceae	1
Brassicaceae	1
Gnetaceae	1
Rubiaceae	1
Apocynaceae	1
Asteraceae	1
Cannabaceae	1
Nectriaceae	1
Magnaporthaceae	1

KEGG BRITE br08003

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Categories (2)

br08003 Category	# of metabolite
Pyridine alkaloids	2
Piperidine alkaloids	1

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metabolites link (3)

br08003 Category	KEGG ID	KNApSAcK ID
Pyridine alkaloids	C00253	C00000208
Pyridine alkaloids	C01004	C00001555
Piperidine alkaloids	C10164	C00002063

Metabolite list (3)

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
C00000208	Nicotinic acid	CHEMBL573 CHEMBL2074803	D009525	100 / 38 / 34	48 / 110
C00001555	Trigonelline	CHEMBL350675	C009560	3 / 1 / 0
C00002063	Picolinic acid	CHEMBL72628	C030614	16 / 15 / 14	5 / 6

Human Protein / Gene in interactions

115 ChEMBL Protein in interactions

accession	description	class description	KNApSAcK metabolite in interactions	# of diseases (OMIM / KEGG)
Q9UIF8	Bromodomain adjacent to zinc finger domain protein 2B	Unclassified protein	C00000208 C00002063	0 / 0
O75164	Lysine-specific demethylase 4A	Enzyme	C00000208 C00002063	0 / 0
P03956	Interstitial collagenase	M10A	C00000208 C00002063	0 / 1
P14780	Matrix metalloproteinase-9	M10A	C00000208 C00002063	2 / 2
P08253	72 kDa type IV collagenase	M10A	C00002063	1 / 3
P21728	D(1A) dopamine receptor	Dopamine receptor	C00000208	0 / 0
P35354	Prostaglandin G/H synthase 2	Oxidoreductase	C00000208	0 / 3
Q12809	Potassium voltage-gated channel subfamily H member 2	KCNH, Kv10-12.x (Ether-a-go-go)	C00000208	2 / 2
P08246	Neutrophil elastase	S1A	C00000208	2 / 1
P33765	Adenosine receptor A3	Adenosine receptor	C00000208	0 / 0
Q16539	Mitogen-activated protein kinase 14	p38	C00000208	0 / 0
P49146	Neuropeptide Y receptor type 2	Neuropeptide Y receptor	C00000208	0 / 0
P10253	Lysosomal alpha-glucosidase	Hydrolase	C00000208	1 / 1
P22894	Neutrophil collagenase	M10A	C00002063	0 / 0
P29466	Caspase-1	C14	C00000208	0 / 0
P17252	Protein kinase C alpha type	Alpha	C00000208	0 / 0
P27361	Mitogen-activated protein kinase 3	Erk	C00000208	0 / 0
Q96FL8	Multidrug and toxin extrusion protein 1	Cation antiporter	C00000208	0 / 0
O75604	Ubiquitin carboxyl-terminal hydrolase 2	Enzyme	C00001555	0 / 0
P02545	Prelamin-A/C	Unclassified protein	C00002063	11 / 10
P00918	Carbonic anhydrase 2	Lyase	C00000208	1 / 2
P07550	Beta-2 adrenergic receptor	Adrenergic receptor	C00000208	0 / 1
P21397	Amine oxidase [flavin-containing] A	Oxidoreductase	C00000208	1 / 1
P25021	Histamine H2 receptor	Histamine receptor	C00000208	0 / 0
P35367	Histamine H1 receptor	Histamine receptor	C00000208	0 / 0
Q01959	Sodium-dependent dopamine transporter	Dopamine	C00000208	1 / 0
P08912	Muscarinic acetylcholine receptor M5	Acetylcholine receptor	C00000208	0 / 0
P18825	Alpha-2C adrenergic receptor	Adrenergic receptor	C00000208	0 / 0
P13945	Beta-3 adrenergic receptor	Adrenergic receptor	C00000208	0 / 0
P25024	C-X-C chemokine receptor type 1	CXC chemokine receptor	C00000208	0 / 0
P06241	Tyrosine-protein kinase Fyn	Src	C00000208	0 / 0
Q08209	Serine/threonine-protein phosphatase 2B catalytic subunit alpha isoform	Ser_Thr	C00000208	0 / 0
P11712	Cytochrome P450 2C9	Cytochrome P450 2C9	C00000208	0 / 1
P00533	Epidermal growth factor receptor	TK tyrosine-protein kinase EGFR subfamily	C00000208	1 / 8
P14416	D(2) dopamine receptor	Dopamine receptor	C00000208	2 / 0
P23219	Prostaglandin G/H synthase 1	Oxidoreductase	C00000208	0 / 0
P37288	Vasopressin V1a receptor	Vasopressin and oxytocin receptor	C00000208	0 / 0
P41145	Kappa-type opioid receptor	Opioid receptor	C00000208	0 / 0
Q9Y271	Cysteinyl leukotriene receptor 1	Leukotriene receptor	C00000208	0 / 0
P29274	Adenosine receptor A2a	Adenosine receptor	C00000208	0 / 0
P25929	Neuropeptide Y receptor type 1	Neuropeptide Y receptor	C00000208	0 / 0
P50052	Type-2 angiotensin II receptor	Angiotensin receptor	C00000208	1 / 1
P17948	Vascular endothelial growth factor receptor 1	Vegfr	C00000208	0 / 0
P41968	Melanocortin receptor 3	Melanocortin receptor	C00000208	1 / 0
P00352	Retinal dehydrogenase 1	Enzyme	C00000208	0 / 0
P11509	Cytochrome P450 2A6	Cytochrome P450 2A6	C00000208	0 / 0
Q8TDS4	Hydroxycarboxylic acid receptor 2	Hydroxycarboxylic acid receptor	C00000208	0 / 0
P39748	Flap endonuclease 1	Enzyme	C00002063	0 / 0
O75496	Geminin	Unclassified protein	C00002063	0 / 0
Q9BXC0	Hydroxycarboxylic acid receptor 1	Hydroxycarboxylic acid receptor	C00000208	0 / 0
P04035	3-hydroxy-3-methylglutaryl-coenzyme A reductase	Oxidoreductase	C00000208	0 / 0
P08913	Alpha-2A adrenergic receptor	Adrenergic receptor	C00000208	0 / 0
P21917	D(4) dopamine receptor	Dopamine receptor	C00000208	0 / 0
P30988	Calcitonin receptor	Calcitonin receptor	C00000208	0 / 0
P35462	D(3) dopamine receptor	Dopamine receptor	C00000208	1 / 0
P41143	Delta-type opioid receptor	Opioid receptor	C00000208	0 / 0
Q92731	Estrogen receptor beta	NR3A2	C00000208	0 / 1
P41595	5-hydroxytryptamine receptor 2B	Serotonin receptor	C00000208	0 / 0
P25101	Endothelin-1 receptor	Endothelin receptor	C00000208	0 / 0
P30411	B2 bradykinin receptor	Bradykinin receptor	C00000208	0 / 0
P32245	Melanocortin receptor 4	Melanocortin receptor	C00000208	1 / 0
P32238	Cholecystokinin receptor type A	Cholecystokinin receptor	C00000208	0 / 0
P08311	Cathepsin G	S1A	C00000208	0 / 0
Q99720	Sigma non-opioid intracellular receptor 1	Membrane receptor	C00000208	1 / 0
Q9NXG6	Transmembrane prolyl 4-hydroxylase	Enzyme	C00002063	0 / 0
P43220	Glucagon-like peptide 1 receptor	Glucagon-like peptide receptor	C00000208	0 / 0
O94956	Solute carrier organic anion transporter family member 2B1	Unclassified protein	C00000208	0 / 0
P32241	Vasoactive intestinal polypeptide receptor 1	Vasoactive intestinal peptide receptor	C00000208	0 / 0
Q9Y468	Lethal(3)malignant brain tumor-like protein 1	Unclassified protein	C00002063	0 / 0
P83916	Chromobox protein homolog 1	Unclassified protein	C00001555	0 / 0
P04150	Glucocorticoid receptor	NR3C1	C00000208	0 / 1
P08172	Muscarinic acetylcholine receptor M2	Acetylcholine receptor	C00000208	2 / 0
P11229	Muscarinic acetylcholine receptor M1	Acetylcholine receptor	C00000208	0 / 0
P21554	Cannabinoid receptor 1	Cannabinoid receptor	C00000208	0 / 0
P31645	Sodium-dependent serotonin transporter	Serotonin	C00000208	2 / 0
P04626	Receptor tyrosine-protein kinase erbB-2	TK tyrosine-protein kinase EGFR subfamily	C00000208	5 / 9
P20309	Muscarinic acetylcholine receptor M3	Acetylcholine receptor	C00000208	1 / 0
P21452	Substance-K receptor	Neurokinin receptor	C00000208	0 / 0
P51679	C-C chemokine receptor type 4	CC chemokine receptor	C00000208	0 / 0
P51681	C-C chemokine receptor type 5	CC chemokine receptor	C00000208	3 / 0
P50406	5-hydroxytryptamine receptor 6	Serotonin receptor	C00000208	0 / 0
P41597	C-C chemokine receptor type 2	CC chemokine receptor	C00000208	1 / 0
P28482	Mitogen-activated protein kinase 1	Erk	C00000208	0 / 0
P08575	Receptor-type tyrosine-protein phosphatase C	Enzyme	C00000208	2 / 1
P05177	Cytochrome P450 1A2	Cytochrome P450 1A2	C00000208	0 / 0
P09917	Arachidonate 5-lipoxygenase	Oxidoreductase	C00002063	0 / 0
O76074	cGMP-specific 3',5'-cyclic phosphodiesterase	PDE_5A	C00000208	0 / 0
P03372	Estrogen receptor	NR3A1	C00000208	1 / 1
P08588	Beta-1 adrenergic receptor	Adrenergic receptor	C00000208	1 / 0
P22303	Acetylcholinesterase	Hydrolase	C00000208	1 / 0
P28223	5-hydroxytryptamine receptor 2A	Serotonin receptor	C00000208	0 / 0
P28335	5-hydroxytryptamine receptor 2C	Serotonin receptor	C00000208	0 / 0
P35372	Mu-type opioid receptor	Opioid receptor	C00000208	0 / 0
P08173	Muscarinic acetylcholine receptor M4	Acetylcholine receptor	C00000208	0 / 0
P25103	Substance-P receptor	Neurokinin receptor	C00000208	0 / 0
P25105	Platelet-activating factor receptor	PAF receptor	C00000208	0 / 0
P33032	Melanocortin receptor 5	Melanocortin receptor	C00000208	0 / 0
P33261	Cytochrome P450 2C19	Cytochrome P450 2C19	C00000208	1 / 1
P08684	Cytochrome P450 3A4	Cytochrome P450 3A4	C00000208	0 / 1
P05181	Cytochrome P450 2E1	Cytochrome P450 2E1	C00000208	0 / 0
P49019	Hydroxycarboxylic acid receptor 3	Hydroxycarboxylic acid receptor	C00000208	0 / 0
Q9UNA4	DNA polymerase iota	Enzyme	C00002063	0 / 0
P10635	Cytochrome P450 2D6	Cytochrome P450 2D6	C00000208	1 / 0
Q7Z2H8	Proton-coupled amino acid transporter 1	Unclassified protein	C00002063	0 / 0
P23975	Sodium-dependent noradrenaline transporter	Norepinephrine	C00000208	1 / 1
P25100	Alpha-1D adrenergic receptor	Adrenergic receptor	C00000208	0 / 0
P30542	Adenosine receptor A1	Adenosine receptor	C00000208	0 / 0
P18089	Alpha-2B adrenergic receptor	Adrenergic receptor	C00000208	0 / 0
P24557	Thromboxane-A synthase	Cytochrome P450 5A1	C00000208	1 / 1
P06239	Tyrosine-protein kinase Lck	Src	C00000208	0 / 1
P25025	C-X-C chemokine receptor type 2	CXC chemokine receptor	C00000208	0 / 0
P08254	Stromelysin-1	M10A	C00002063	1 / 0
Q96KQ7	Histone-lysine N-methyltransferase EHMT2	Enzyme	C00002063	0 / 0
O75874	Isocitrate dehydrogenase [NADP] cytoplasmic	Enzyme	C00001555	1 / 0
O76082	Solute carrier family 22 member 5	Unclassified protein	C00000208	1 / 2

50 Gene in CTD interactions

gene	gene name	gene description	KNApSAcK metabolite in interactions
6347	CCL2, GDCF-2, HC11, HSMCR30, MCAF, MCP-1, MCP1, SCYA2, SMC-CF	chemokine (C-C motif) ligand 2	C00000208 C00002063
3576	IL8, CXCL8, GCP-1, GCP1, LECT, LUCT, LYNAP, MDNCF, MONAP, NAF, NAP-1, NAP1	interleukin 8	C00000208 C00002063
3569	IL6, BSF2, HGF, HSF, IFNB2, IL-6	interleukin 6 (interferon, beta 2)	C00000208 C00002063
3553	IL1B, IL-1, IL1-BETA, IL1F2	interleukin 1, beta	C00000208
836	CASP3, CPP32, CPP32B, SCA-1	caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56)	C00002063
19	ABCA1, ABC-1, ABC1, CERP, HDLDT1, TGD	ATP-binding cassette, sub-family A (ABC1), member 1	C00000208
9370	ADIPOQ, ACDC, ACRP30, ADIPQTL1, ADPN, APM-1, APM1, GBP28	adiponectin, C1Q and collagen domain containing	C00000208
183	AGT, ANHU, SERPINA8	angiotensinogen (serpin peptidase inhibitor, clade A, member 8)	C00000208
197	AHSG, A2HS, AHS, FETUA, HSGA	alpha-2-HS-glycoprotein	C00000208
335	APOA1	apolipoprotein A-I	C00000208
338	APOB, FLDB, LDLCQ4	apolipoprotein B	C00000208
506	ATP5B, ATPMB, ATPSB	ATP synthase, H+ transporting, mitochondrial F1 complex, beta polypeptide (EC:3.6.3.14)	C00000208
1050	CEBPA, C/EBP-alpha, CEBP	CCAAT/enhancer binding protein (C/EBP), alpha	C00000208
1052	CEBPD, C/EBP-delta, CELF, CRP3, NF-IL6-beta	CCAAT/enhancer binding protein (C/EBP), delta	C00000208
1376	CPT2, CPT1, CPTASE, IIAE4	carnitine palmitoyltransferase 2 (EC:2.3.1.21)	C00000208
1401	CRP, PTX1	C-reactive protein, pentraxin-related	C00000208
84649	DGAT2, ARAT, GS1999FULL	diacylglycerol O-acyltransferase 2 (EC:2.3.1.20 2.3.1.76)	C00000208
2149	F2R, CF2R, HTR, PAR-1, PAR1, TR	coagulation factor II (thrombin) receptor	C00000208
2194	FASN, FAS, OA-519, SDR27X1	fatty acid synthase (EC:2.3.1.85 2.3.1.38 2.3.1.39 2.3.1.41 3.1.2.14 4.2.1.59 1.1.1.100 1.3.1.39)	C00000208
2641	GCG, GLP1, GLP2, GRPP	glucagon	C00000208
2688	GH1, GH, GH-N, GHN, IGHD1B, hGH-N	growth hormone 1	C00000208
338442	HCAR2, GPR109A, HCA2, HM74a, HM74b, NIACR1, PUMAG, Puma-g	hydroxycarboxylic acid receptor 2	C00000208
8843	HCAR3, GPR109B, HCA3, HM74, PUMAG, Puma-g	hydroxycarboxylic acid receptor 3	C00000208
3383	ICAM1, BB2, CD54, P3.58	intercellular adhesion molecule 1	C00000208
3458	IFNG, IFG, IFI	interferon, gamma	C00000208
3039	HBA1, CD31, HBH	hemoglobin, alpha 1	C00002063
3952	LEP, LEPD, OB, OBS	leptin	C00000208
3991	LIPE, HSL, LHS	lipase, hormone-sensitive (EC:3.1.1.79)	C00000208
4018	LPA, AK38, APOA, LP	lipoprotein, Lp(a) (EC:3.4.21.-)	C00000208
5594	MAPK1, ERK, ERK2, ERT1, MAPK2, P42MAPK, PRKM1, PRKM2, p38, p40, p41, p41mapk	mitogen-activated protein kinase 1 (EC:2.7.11.24)	C00000208
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)	C00000208
10062	NR1H3, LXR-a, LXRA, RLD-1	nuclear receptor subfamily 1, group H, member 3	C00000208
142	PARP1, ADPRT, ADPRT_1, ADPRT1, ARTD1, PARP, PARP-1, PPOL, pADPRT-1	poly (ADP-ribose) polymerase 1 (EC:2.4.2.30)	C00000208
5175	PECAM1, CD31, CD31/EndoCAM, GPIIA', PECA1, PECAM-1, endoCAM	platelet/endothelial cell adhesion molecule 1	C00000208
7941	PLA2G7, LDL-PLA2, LP-PLA2, PAFAD, PAFAH	phospholipase A2, group VII (platelet-activating factor acetylhydrolase, plasma) (EC:3.1.1.47)	C00000208
5465	PPARA, NR1C1, PPAR, PPARalpha, hPPAR	peroxisome proliferator-activated receptor alpha	C00000208
5468	PPARG, CIMT1, GLM1, NR1C3, PPARG1, PPARG2, PPARgamma	peroxisome proliferator-activated receptor gamma	C00000208
10891	PPARGC1A, LEM6, PGC-1(alpha), PGC-1v, PGC1, PGC1A, PPARGC1	peroxisome proliferator-activated receptor gamma, coactivator 1 alpha	C00000208
5563	PRKAA2, AMPK, AMPK2, AMPKa2, PRKAA	protein kinase, AMP-activated, alpha 2 catalytic subunit (EC:2.7.11.1 2.7.11.27 2.7.11.31)	C00000208
5729	PTGDR, AS1, ASRT1, DP, DP1, PTGDR1	prostaglandin D2 receptor (DP)	C00000208
5730	PTGDS, L-PGDS, LPGDS, PDS, PGD2, PGDS, PGDS2	prostaglandin D2 synthase 21kDa (brain) (EC:5.3.99.2)	C00000208
5742	PTGS1, COX1, COX3, PCOX1, PES-1, PGG/HS, PGHS-1, PGHS1, PHS1, PTGHS	prostaglandin-endoperoxide synthase 1 (prostaglandin G/H synthase and cyclooxygenase) (EC:1.14.99.1)	C00000208
5970	RELA, NFKB3, p65	v-rel avian reticuloendotheliosis viral oncogene homolog A	C00000208
56729	RETN, ADSF, FIZZ3, RETN1, RSTN, XCP1	resistin	C00000208
949	SCARB1, CD36L1, CLA-1, CLA1, HDLQTL6, SR-BI, SRB1	scavenger receptor class B, member 1	C00000208
5054	SERPINE1, PAI, PAI-1, PAI1, PLANH1	serpin peptidase inhibitor, clade E (nexin, plasminogen activator inhibitor type 1), member 1	C00000208
7040	TGFB1, CED, DPD1, LAP, TGFB, TGFbeta	transforming growth factor, beta 1	C00000208
7124	TNF, DIF, TNF-alpha, TNFA, TNFSF2	tumor necrosis factor	C00000208
7412	VCAM1, CD106, INCAM-100	vascular cell adhesion molecule 1	C00000208
7448	VTN, V75, VN, VNT	vitronectin	C00000208

Related Diseases

Diseases related to proteins in ChEMBL interactions

Diseases related to CTD interactions