KCF-S cluster No. 171 (34 metabolites)
Corresponding Phytochemical cluster No. 11
Plant Species
Cumulative plant class count
| class name | count |
|---|---|
| Liliopsida | 131 |
| asterids | 35 |
| rosids | 6 |
| eudicotyledons | 1 |
Cumulative family count
| class name | count |
|---|---|
| Asparagaceae | 70 |
| Dioscoreaceae | 31 |
| Solanaceae | 28 |
| Amaryllidaceae | 11 |
| Smilacaceae | 6 |
| Plantaginaceae | 6 |
| Melanthiaceae | 5 |
| Fabaceae | 4 |
| Zygophyllaceae | 2 |
| Liliaceae | 2 |
| Arecaceae | 2 |
| Costaceae | 2 |
| Poaceae | 1 |
| Ruscaceae | 1 |
| Apiaceae | 1 |
| Ranunculaceae | 1 |
KEGG BRITE br08003
Categories (2)
| br08003 Category | # of metabolite |
|---|---|
| Steroid alkaloids | 2 |
| Spirostan | 11 |
metabolites link (14)
Metabolite list (34)
| 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 |
|---|---|---|---|---|---|---|
|
C00002264
|
Solasodine
|
CHEMBL372484
CHEMBL518252 CHEMBL514596 CHEMBL1485302 CHEMBL1515688 CHEMBL1741560 CHEMBL1964743 |
C012037
|
12 / 14 / 46 |
|
|
|
C00002267
|
Tomatidine
|
CHEMBL365417
CHEMBL1476096 CHEMBL1622974 CHEMBL1976775 CHEMBL1998601 CHEMBL2165711 |
C003677
|
10 / 15 / 14 |
|
|
|
C00003567
|
Convallagenin A
|
|
||||
|
C00003568
|
Convallamarogenin
|
|
||||
|
C00003573
|
Digitogenin
|
|
||||
|
C00003576
|
Diosgenin
|
CHEMBL412437
CHEMBL1551855 CHEMBL1553328 |
D004144
|
6 / 10 / 7 | 15 / 2 |
|
|
C00003577
|
Gitogenin
|
CHEMBL1770687
|
C012999
|
|
||
|
C00003581
|
Nuatigenin
|
|
||||
|
C00003587
|
Ruscogenin
|
CHEMBL1169820
|
C012541
|
|
||
|
C00003590
|
Sarsasapogenin
|
CHEMBL43871
CHEMBL1171146 CHEMBL1475613 |
3 / 5 / 1 |
|
||
|
C00003592
|
Smilagenin
/ Isosarsasapogenin |
CHEMBL43871
CHEMBL1171146 CHEMBL1475613 |
3 / 5 / 1 |
|
||
|
C00003593
|
Tigogenin
|
CHEMBL43871
CHEMBL1171146 CHEMBL1475613 |
3 / 5 / 1 |
|
||
|
C00003597
|
Yamogenin
|
CHEMBL412437
CHEMBL1551855 CHEMBL1553328 |
6 / 10 / 7 |
|
||
|
C00025533
|
Megacarpidin
/ Soladulcidine / Megacarpidine / 5alpha,25D-Solasodan-3b-ol |
CHEMBL365417
CHEMBL1476096 CHEMBL1622974 CHEMBL1976775 CHEMBL1998601 CHEMBL2165711 |
10 / 15 / 14 |
|
||
|
C00029023
|
Soladulcidine
|
CHEMBL365417
CHEMBL1476096 CHEMBL1622974 CHEMBL1976775 CHEMBL1998601 CHEMBL2165711 |
10 / 15 / 14 |
|
||
|
C00029137
|
Tomatidenol
|
CHEMBL372484
CHEMBL518252 CHEMBL514596 CHEMBL1485302 CHEMBL1515688 CHEMBL1741560 CHEMBL1964743 |
12 / 14 / 46 |
|
||
|
C00031901
|
Isoesculeogenin A
|
CHEMBL1269939
|
2 / 0 / 0 |
|
||
|
C00032186
|
Spirostanol
|
CHEMBL43871
CHEMBL1171146 CHEMBL1475613 |
3 / 5 / 1 |
|
||
|
C00033339
|
Ranmogenin A
/ (-)-Ranmogenin A |
CHEMBL516162
|
|
|||
|
C00033457
|
Tupichigenin B
/ (-)-Tupichigenin B |
|
||||
|
C00033458
|
Tupichigenin C
/ (-)-Tupichigenin C |
|
||||
|
C00034279
|
Spirosta-5,25(27)-diene-1beta,3beta,11alpha-triol
|
|
||||
|
C00036016
|
5alpha-Spirostan-3beta,12beta,15alpha-triol
|
|
||||
|
C00041366
|
Atroviolacegenin
/ (-)-Atroviolacegenin |
CHEMBL522863
|
|
|||
|
C00045127
|
Tupichigenin D
/ (-)-Tupichigenin D |
CHEMBL516162
|
|
|||
|
C00045128
|
Tupichigenin E
/ (-)-Tupichigenin E |
|
||||
|
C00045129
|
Tupichigenin F
/ (-)-Tupichigenin F |
|
||||
|
C00047115
|
Tupichigenin A
/ (-)-Tupichigenin A |
CHEMBL463609
|
|
|||
|
C00050327
|
Agigenin
|
CHEMBL468875
CHEMBL512238 |
|
|||
|
C00050386
|
Neoagigenin
|
CHEMBL468875
CHEMBL512238 |
|
|||
|
C00050387
|
Neoporrigenin A
/ (-)-Neoporrigenin A |
CHEMBL468875
CHEMBL512238 |
|
|||
|
C00050388
|
Neoporrigenin B
/ (-)-Neoporrigenin B |
CHEMBL466376
|
|
|||
|
C00050397
|
Porrigenin A
/ (-)-Porrigenin A |
CHEMBL468875
CHEMBL512238 |
|
|||
|
C00050398
|
Porrigenin B
/ (-)-Porrigenin B |
CHEMBL466376
|
|
Human Protein / Gene in interactions
22 ChEMBL Protein in interactions
| accession | description | class description | KNApSAcK metabolite in interactions |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|
| P08684 | Cytochrome P450 3A4 | Cytochrome P450 3A4 | C00002264 C00002267 C00003576 C00003597 C00025533 C00029023 C00029137 | 0 / 1 |
| P22309 | UDP-glucuronosyltransferase 1-1 | Enzyme | C00003576 C00003590 C00003592 C00003593 C00003597 C00032186 | 5 / 1 |
| P22310 | UDP-glucuronosyltransferase 1-4 | Enzyme | C00003576 C00003590 C00003592 C00003593 C00003597 C00032186 | 3 / 0 |
| Q15125 | 3-beta-hydroxysteroid-Delta(8),Delta(7)-isomerase | Enzyme | C00002264 C00002267 C00025533 C00029023 C00029137 | 1 / 1 |
| P33261 | Cytochrome P450 2C19 | Cytochrome P450 2C19 | C00002264 C00002267 C00025533 C00029023 C00029137 | 1 / 1 |
| Q99720 | Sigma non-opioid intracellular receptor 1 | Membrane receptor | C00002264 C00002267 C00025533 C00029023 C00029137 | 1 / 0 |
| P10635 | Cytochrome P450 2D6 | Cytochrome P450 2D6 | C00002264 C00002267 C00025533 C00029023 C00029137 | 1 / 0 |
| P11712 | Cytochrome P450 2C9 | Cytochrome P450 2C9 | C00002264 C00002267 C00025533 C00029023 C00029137 | 0 / 1 |
| P00352 | Retinal dehydrogenase 1 | Enzyme | C00002264 C00002267 C00025533 C00029023 C00029137 | 0 / 0 |
| P05177 | Cytochrome P450 1A2 | Cytochrome P450 1A2 | C00002264 C00002267 C00025533 C00029023 C00029137 | 0 / 0 |
| B2RXH2 | Lysine-specific demethylase 4E | Enzyme | C00003590 C00003592 C00003593 C00032186 | 0 / 0 |
| O75604 | Ubiquitin carboxyl-terminal hydrolase 2 | Enzyme | C00002267 C00025533 C00029023 | 0 / 0 |
| P02545 | Prelamin-A/C | Unclassified protein | C00002267 C00025533 C00029023 | 11 / 10 |
| P40763 | Signal transducer and activator of transcription 3 | Transcription Factor | C00003576 C00003597 | 1 / 2 |
| Q9HAW9 | UDP-glucuronosyltransferase 1-8 | Enzyme | C00003576 C00003597 | 0 / 0 |
| P28482 | Mitogen-activated protein kinase 1 | Erk | C00002264 C00029137 | 0 / 0 |
| Q03164 | Histone-lysine N-methyltransferase 2A | Enzyme | C00002264 C00029137 | 1 / 2 |
| P04637 | Cellular tumor antigen p53 | Transcription Factor | C00002264 C00029137 | 7 / 37 |
| O00255 | Menin | Unclassified protein | C00002264 C00029137 | 2 / 5 |
| P10636 | Microtubule-associated protein tau | Unclassified protein | C00003576 C00003597 | 4 / 3 |
| P35610 | Sterol O-acyltransferase 1 | Enzyme | C00031901 | 0 / 0 |
| O75908 | Sterol O-acyltransferase 2 | Enzyme | C00031901 | 0 / 0 |
15 Gene in CTD interactions
| gene | gene name | gene description | KNApSAcK metabolite in interactions |
|---|---|---|---|
| 207 | AKT1, AKT, CWS6, PKB, PKB-ALPHA, PRKBA, RAC, RAC-ALPHA | v-akt murine thymoma viral oncogene homolog 1 (EC:2.7.11.1) |
C00003576
|
| 596 | BCL2, Bcl-2, PPP1R50 | B-cell CLL/lymphoma 2 |
C00003576
|
| 597 | BCL2A1, ACC-1, ACC-2, BCL2L5, BFL1, GRS, HBPA1 | BCL2-related protein A1 |
C00003576
|
| 598 | BCL2L1, BCL-XL/S, BCL2L, BCLX, BCLXL, BCLXS, Bcl-X, PPP1R52, bcl-xL, bcl-xS | BCL2-like 1 |
C00003576
|
| 329 | BIRC2, API1, HIAP2, Hiap-2, MIHB, RNF48, c-IAP1, cIAP1 | baculoviral IAP repeat containing 2 |
C00003576
|
| 595 | CCND1, BCL1, D11S287E, PRAD1, U21B31 | cyclin D1 |
C00003576
|
| 8837 | CFLAR, CASH, CASP8AP1, CLARP, Casper, FLAME, FLAME-1, FLAME1, FLIP, I-FLICE, MRIT, c-FLIP, c-FLIPL, c-FLIPR, c-FLIPS | CASP8 and FADD-like apoptosis regulator |
C00003576
|
| 4318 | MMP9, CLG4B, GELB, MANDP2, MMP-9 | matrix metallopeptidase 9 (gelatinase B, 92kDa gelatinase, 92kDa type IV collagenase) (EC:3.4.24.35) |
C00003576
|
| 4609 | MYC, MRTL, MYCC, bHLHe39, c-Myc | v-myc avian myelocytomatosis viral oncogene homolog |
C00003576
|
| 4790 | NFKB1, EBP-1, KBF1, NF-kB1, NF-kappa-B, NF-kappaB, NFKB-p105, NFKB-p50, NFkappaB, p105, p50 | nuclear factor of kappa light polypeptide gene enhancer in B-cells 1 |
C00003576
|
| 4792 | NFKBIA, IKBA, MAD-3, NFKBI | nuclear factor of kappa light polypeptide gene enhancer in B-cells inhibitor, alpha |
C00003576
|
| 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) |
C00003576
|
| 5970 | RELA, NFKB3, p65 | v-rel avian reticuloendotheliosis viral oncogene homolog A |
C00003576
|
| 7124 | TNF, DIF, TNF-alpha, TNFA, TNFSF2 | tumor necrosis factor |
C00003576
|
| 7422 | VEGFA, MVCD1, VEGF, VPF | vascular endothelial growth factor A |
C00003576
|
Related Diseases
Diseases related to proteins in ChEMBL interactions
OMIM (35)
| OMIM | preferred title | UniProt |
|---|---|---|
| #202300 | Adrenocortical carcinoma, hereditary; adcc |
P04637
|
| #614373 | Amyotrophic lateral sclerosis 16, juvenile; als16 |
Q99720
|
| #614740 | Basal cell carcinoma, susceptibility to, 7; bcc7 |
P04637
|
| #601816 | Bilirubin, serum level of, quantitative trait locus 1; biliqtl1 |
P22309
|
| #115200 | Cardiomyopathy, dilated, 1a; cmd1a |
P02545
|
| #212112 | Cardiomyopathy, dilated, with hypergonadotropic hypogonadism |
P02545
|
| #605588 | Charcot-marie-tooth disease, axonal, type 2b1; cmt2b1 |
P02545
|
| #302960 | Chondrodysplasia punctata 2, x-linked dominant; cdpx2 |
Q15125
|
| #218800 | Crigler-najjar syndrome, type i |
P22309
P22310 |
| #606785 | Crigler-najjar syndrome, type ii |
P22309
P22310 |
| #609535 | Drug metabolism, poor, cyp2c19-related |
P33261
|
| #608902 | Drug metabolism, poor, cyp2d6-related |
P10635
|
| #181350 | Emery-dreifuss muscular dystrophy 2, autosomal dominant; edmd2 |
P02545
|
| #133239 | Esophageal cancer |
P04637
|
| #600274 | Frontotemporal dementia; ftd |
P10636
|
| #143500 | Gilbert syndrome |
P22309
P22310 |
| #605130 | Hairy elbows, short stature, facial dysmorphism, and developmental delay |
Q03164
|
| #610140 | Heart-hand syndrome, slovenian type |
P02545
|
| #176670 | Hutchinson-gilford progeria syndrome; hgps |
P02545
|
| #147060 | Hyper-ige recurrent infection syndrome, autosomal dominant |
P40763
|
| #237900 | Hyperbilirubinemia, transient familial neonatal; hblrtfn |
P22309
|
| #145000 | Hyperparathyroidism 1; hrpt1 |
O00255
|
| #151623 | Li-fraumeni syndrome 1; lfs1 |
P04637
|
| #151660 | Lipodystrophy, familial partial, type 2; fpld2 |
P02545
|
| #211980 | Lung cancer |
P04637
|
| #248370 | Mandibuloacral dysplasia with type a lipodystrophy; mada |
P02545
|
| #131100 | Multiple endocrine neoplasia, type i; men1 |
O00255
|
| #613205 | Muscular dystrophy, congenital, lmna-related |
P02545
|
| #159001 | Muscular dystrophy, limb-girdle, type 1b; lgmd1b |
P02545
|
| #260500 | Papilloma of choroid plexus; cpp |
P04637
|
| #260540 | Parkinson-dementia syndrome |
P10636
|
| #172700 | Pick disease of brain |
P10636
|
| #275210 | Restrictive dermopathy, lethal |
P02545
|
| #275355 | Squamous cell carcinoma, head and neck; hnscc |
P04637
|
| #601104 | Supranuclear palsy, progressive, 1; psnp1 |
P10636
|
KEGG DISEASE (61)
| KEGG | name | UniProt |
|---|---|---|
| H00033 | Adrenal carcinoma |
O00255
(related)
P04637 (related) |
| H00034 | Carcinoid |
O00255
(related)
|
| H00045 | Malignant islet cell carcinoma |
O00255
(related)
|
| H00246 | Primary hyperparathyroidism |
O00255
(related)
|
| H01102 | Pituitary adenomas |
O00255
(related)
|
| H00264 | Charcot-Marie-Tooth disease (CMT) |
P02545
(related)
|
| H00294 | Dilated cardiomyopathy (DCM) |
P02545
(related)
|
| H00420 | Familial partial lipodystrophy (FPL) |
P02545
(related)
|
| H00563 | Emery-Dreifuss muscular dystrophy |
P02545
(related)
|
| H00590 | Congenital muscular dystrophies (CMD/MDC) |
P02545
(related)
|
| H00593 | Limb-girdle muscular dystrophy (LGMD) |
P02545
(related)
|
| H00601 | Hutchinson-Gilford progeria syndrome |
P02545
(related)
|
| H00663 | Restrictive dermopathy |
P02545
(related)
|
| H00665 | Mandibuloacral dysplasia |
P02545
(related)
|
| H01216 | Left ventricular noncompaction (LVNC) |
P02545
(related)
|
| H00004 | Chronic myeloid leukemia (CML) |
P04637
(related)
|
| H00005 | Chronic lymphocytic leukemia (CLL) |
P04637
(related)
|
| H00006 | Hairy-cell leukemia |
P04637
(related)
|
| H00008 | Burkitt lymphoma |
P04637
(related)
|
| H00009 | Adult T-cell leukemia |
P04637
(related)
|
| H00010 | Multiple myeloma |
P04637
(related)
|
| H00013 | Small cell lung cancer |
P04637
(related)
|
| H00014 | Non-small cell lung cancer |
P04637
(related)
|
| H00015 | Malignant pleural mesothelioma |
P04637
(related)
|
| H00016 | Oral cancer |
P04637
(related)
P04637 (marker) P40763 (related) |
| H00017 | Esophageal cancer |
P04637
(related)
P04637 (marker) |
| H00018 | Gastric cancer |
P04637
(related)
|
| H00019 | Pancreatic cancer |
P04637
(related)
P04637 (marker) |
| H00020 | Colorectal cancer |
P04637
(related)
P04637 (marker) |
| H00022 | Bladder cancer |
P04637
(related)
|
| H00025 | Penile cancer |
P04637
(related)
P04637 (marker) |
| H00026 | Endometrial Cancer |
P04637
(related)
|
| H00027 | Ovarian cancer |
P04637
(related)
|
| H00028 | Choriocarcinoma |
P04637
(related)
|
| H00029 | Vulvar cancer |
P04637
(related)
|
| H00031 | Breast cancer |
P04637
(related)
|
| H00032 | Thyroid cancer |
P04637
(related)
|
| H00036 | Osteosarcoma |
P04637
(related)
P08684 (marker) |
| H00038 | Malignant melanoma |
P04637
(related)
|
| H00039 | Basal cell carcinoma |
P04637
(related)
|
| H00040 | Squamous cell carcinoma |
P04637
(related)
|
| H00041 | Kaposi's sarcoma |
P04637
(related)
|
| H00042 | Glioma |
P04637
(related)
P04637 (marker) |
| H00044 | Cancer of the anal canal |
P04637
(related)
|
| H00046 | Cholangiocarcinoma |
P04637
(related)
|
| H00047 | Gallbladder cancer |
P04637
(related)
|
| H00048 | Hepatocellular carcinoma |
P04637
(related)
|
| H00055 | Laryngeal cancer |
P04637
(related)
P04637 (marker) |
| H00881 | Li-Fraumeni syndrome |
P04637
(related)
|
| H01007 | Choroid plexus papilloma |
P04637
(related)
|
| H00021 | Renal cell carcinoma |
P04637
(marker)
|
| H00058 | Amyotrophic lateral sclerosis (ALS) |
P10636
(related)
|
| H00077 | Progressive supranuclear palsy (PSP) |
P10636
(related)
|
| H00078 | Frontotemporal lobar degeneration (FTLD) |
P10636
(related)
|
| H01205 | Coumarin resistance |
P11712
(related)
|
| H00208 | Hyperbilirubinemia |
P22309
(related)
|
| H01171 | Poor drug metabolism (PM) |
P33261
(related)
|
| H00107 | Other well-defined immunodeficiency syndromes |
P40763
(related)
|
| H00001 | Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) |
Q03164
(related)
Q03164 (marker) |
| H00002 | Acute lymphoblastic leukemia (ALL) (precursor T lymphoblastic leukemia) |
Q03164
(related)
|
| H01194 | X-linked chondrodysplasia punctata |
Q15125
(related)
|