KCF-S cluster No. 434 (18 metabolites)
Corresponding Phytochemical cluster No. 57
Plant Species
Cumulative plant class count
| class name | count |
|---|---|
| Liliopsida | 9 |
| rosids | 2 |
| eudicotyledons | 1 |
Cumulative family count
| class name | count |
|---|---|
| Hyacinthaceae | 9 |
| Cunninghamellaceae | 5 |
| Melianthaceae | 2 |
| Bufonidae | 2 |
| Ranunculaceae | 1 |
KEGG BRITE br08003
Categories (1)
| br08003 Category | # of metabolite |
|---|---|
| Bufanolide | 1 |
metabolites link (1)
| br08003 Category | KEGG ID | KNApSAcK ID |
|---|---|---|
| Bufanolide | C08867 | C00003623 |
Metabolite list (18)
| 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 |
|---|---|---|---|---|---|---|
|
C00003623
|
Hellebrigenin 3-acetate
|
|
||||
|
C00032601
|
19-Hydroxyscillarenone
/ 14,19-Dihydroxy-3-oxo-bufa-4,20,22-trienolide |
|
||||
|
C00032648
|
3-epi-Scilliphaeosidin
|
|
||||
|
C00032651
|
3-Methoxy-scilliphaeosidin
|
|
||||
|
C00032654
|
3-Oxo-scilliphaeosidin
|
|
||||
|
C00032664
|
5-beta-14-Dihydroxy-bufa-3,20,22-trienolide
|
|
||||
|
C00033368
|
Scillarenin
|
CHEMBL355996
CHEMBL1982527 |
C047373
|
|
||
|
C00033374
|
Scilliglaucogenin
|
|
||||
|
C00033375
|
Scilliglaucosidin
|
CHEMBL1982770
|
|
|||
|
C00033376
|
Scilliglaucosidone
|
|
||||
|
C00033905
|
Hellebrigenin
/ 3beta,5beta,14beta-Trihydroxy-19-oxo-bufa-20,22-dienolide 3-O-beta-D-glucopyranoside |
CHEMBL2068960
|
C001330
|
|
||
|
C00042046
|
12alpha-Hydroxybufalin
/ (+)-12alpha-Hydroxybufalin |
CHEMBL456081
CHEMBL515657 |
|
|||
|
C00042047
|
12beta-Hydroxybufalin
|
CHEMBL456081
CHEMBL515657 |
|
|||
|
C00042170
|
7beta,12alpha-Dihydroxybufalin
/ (+)-7beta,12alpha-Dihydroxybufalin |
CHEMBL456293
|
|
|||
|
C00042171
|
7beta-Hydroxybufalin
|
|
||||
|
C00042323
|
Bufalin
|
CHEMBL399680
CHEMBL2069047 |
C022777
|
13 / 0 |
|
|
|
C00045523
|
19-Oxobufalin
|
CHEMBL465906
|
|
|||
|
C00045525
|
1beta-Hydroxybufalin
|
CHEMBL458565
|
|
Human Protein / Gene in interactions
13 Gene in CTD interactions
| gene | gene name | gene description | KNApSAcK metabolite in interactions |
|---|---|---|---|
| 5243 | ABCB1, ABC20, CD243, CLCS, GP170, MDR1, P-GP, PGY1 | ATP-binding cassette, sub-family B (MDR/TAP), member 1 (EC:3.6.3.44) |
C00042323
|
| 596 | BCL2, Bcl-2, PPP1R50 | B-cell CLL/lymphoma 2 |
C00042323
|
| 1576 | CYP3A4, CP33, CP34, CYP3A, CYP3A3, CYPIIIA3, CYPIIIA4, HLP, NF-25, P450C3, P450PCN1 | cytochrome P450, family 3, subfamily A, polypeptide 4 (EC:1.14.13.67 1.14.13.97 1.14.13.32 1.14.13.157) |
C00042323
|
| 2353 | FOS, AP-1, C-FOS, p55 | FBJ murine osteosarcoma viral oncogene homolog |
C00042323
|
| 3553 | IL1B, IL-1, IL1-BETA, IL1F2 | interleukin 1, beta |
C00042323
|
| 5594 | MAPK1, ERK, ERK2, ERT1, MAPK2, P42MAPK, PRKM1, PRKM2, p38, p40, p41, p41mapk | mitogen-activated protein kinase 1 (EC:2.7.11.24) |
C00042323
|
| 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) |
C00042323
|
| 5599 | MAPK8, JNK, JNK-46, JNK1, JNK1A2, JNK21B1/2, PRKM8, SAPK1, SAPK1c | mitogen-activated protein kinase 8 (EC:2.7.11.24) |
C00042323
|
| 5601 | MAPK9, JNK-55, JNK2, JNK2A, JNK2ALPHA, JNK2B, JNK2BETA, PRKM9, SAPK, SAPK1a, p54a, p54aSAPK | mitogen-activated protein kinase 9 (EC:2.7.11.24) |
C00042323
|
| 4313 | MMP2, CLG4, CLG4A, MMP-II, MONA, TBE-1 | matrix metallopeptidase 2 (gelatinase A, 72kDa gelatinase, 72kDa type IV collagenase) (EC:3.4.24.24) |
C00042323
|
| 4318 | MMP9, CLG4B, GELB, MANDP2, MMP-9 | matrix metallopeptidase 9 (gelatinase B, 92kDa gelatinase, 92kDa type IV collagenase) (EC:3.4.24.35) |
C00042323
|
| 4609 | MYC, MRTL, MYCC, bHLHe39, c-Myc | v-myc avian myelocytomatosis viral oncogene homolog |
C00042323
|
| 7124 | TNF, DIF, TNF-alpha, TNFA, TNFSF2 | tumor necrosis factor |
C00042323
|