KCF-S cluster No. 291 (23 metabolites)

Corresponding Phytochemical cluster No. 4


Plant Species


Cumulative plant class count

class name count
Magnoliophyta 66

Cumulative family count

class name count
Aristolochiaceae 66

KEGG BRITE br08003 External link 512


Categories (1)

br08003 Category # of metabolite
Isoquinoline alkaloids 1

metabolites link (3)

br08003 Category KEGG ID KNApSAcK ID
Isoquinoline alkaloids C08469 C00001526
Isoquinoline alkaloids C08469 C00027516
Isoquinoline alkaloids C08469 C00032730

Metabolite list (23)

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
C00001526 External link 512 Aristolochic acid I
/ Aristolochic acid A
CHEMBL93353
C000228
13 / 11 / 12 21 / 10
C00021671 External link 512 Aristolochic acid B
/ Aristolochic acid II
CHEMBL602280
C042310
1 / 0 / 0
C00021675 External link 512 7-Methoxyaristolochic acid II
C00027125 External link 512 Aristolochic acid D
/ Aristolochic acid IVa
CHEMBL604748
3 / 0 / 0
C00027126 External link 512 Aristolochic acid Ia methyl ester
C00027290 External link 512 Aristolochic acid III methyl ester
C00027516 External link 512 Aristolochic acid
/ Aristolochic acid I
CHEMBL93353
C000228
13 / 11 / 12 21 / 10
C00027517 External link 512 Aristolochic acid B
/ Aristolochic acid II
CHEMBL602280
C042310
1 / 0 / 0
C00027518 External link 512 Aristolochic acid III
CHEMBL601027
1 / 0 / 0
C00027519 External link 512 Aristolochic acid C
/ Aristolochic acid IIIa
CHEMBL603494
C092652
1 / 0 / 0
C00027520 External link 512 Aristolochic acid VIIa
/ 7-Hydroxyaristolochate A
/ 7-Hydroxyaristolochic acid
/ 7-Hydroxyaristolochic acid I
/ 7-Hydroxy-aristolochic acid A
CHEMBL600828
1 / 0 / 0
C00032724 External link 512 Aristofolin B
C00032726 External link 512 Aristolic acid
CHEMBL486801
C018834
C00032729 External link 512 Aristolochate C
/ Aristolochate IIIa
CHEMBL603494
1 / 0 / 0
C00032730 External link 512 Aristolochate I
CHEMBL93353
13 / 11 / 12
C00032731 External link 512 Aristolochate II
CHEMBL602280
1 / 0 / 0
C00032732 External link 512 Aristolochic acid II methyl ester
C00032766 External link 512 Aristolochate IVa
CHEMBL604748
3 / 0 / 0
C00033191 External link 512 Methyl aristolate
CHEMBL520680
C020920
C00033192 External link 512 Methyl aristolochate
C00044530 External link 512 Aristofolin E
C00044531 External link 512 Aristolochic acid IVa methyl ester
C00044699 External link 512 Demethylaristofolin E
CHEMBL512559

Human Protein / Gene in interactions

14 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
P24941 Cyclin-dependent kinase 2 Cdc2 C00001526 C00021671 C00027125 C00027516 C00027517 C00027518 C00027519 C00027520 C00032729 C00032730 C00032731 C00032766 0 / 0
O75496 Geminin Unclassified protein C00001526 C00027125 C00027516 C00032730 C00032766 0 / 0
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 C00001526 C00027516 C00032730 0 / 1
P00352 Retinal dehydrogenase 1 Enzyme C00001526 C00027516 C00032730 0 / 0
O94925 Glutaminase kidney isoform, mitochondrial Enzyme C00001526 C00027516 C00032730 0 / 0
Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Enzyme C00001526 C00027516 C00032730 0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor C00001526 C00027516 C00032730 0 / 0
Q16637 Survival motor neuron protein Unclassified protein C00001526 C00027516 C00032730 4 / 1
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00001526 C00027516 C00032730 1 / 2
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00001526 C00027516 C00032730 0 / 0
Q8IUX4 DNA dC->dU-editing enzyme APOBEC-3F Enzyme C00001526 C00027516 C00032730 0 / 0
O00255 Menin Unclassified protein C00001526 C00027516 C00032730 2 / 5
P10636 Microtubule-associated protein tau Unclassified protein C00001526 C00027516 C00032730 4 / 3
P39748 Flap endonuclease 1 Enzyme C00027125 C00032766 0 / 0

21 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
59 ACTA2, AAT6, ACTSA, MYMY5 actin, alpha 2, smooth muscle, aorta C00001526 C00027516
655 BMP7, OP-1 bone morphogenetic protein 7 C00001526 C00027516
836 CASP3, CPP32, CPP32B, SCA-1 caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) C00001526 C00027516
999 CDH1, Arc-1, CD324, CDHE, ECAD, LCAM, UVO cadherin 1, type 1, E-cadherin (epithelial) C00001526 C00027516
1543 CYP1A1, AHH, AHRR, CP11, CYP1, P1-450, P450-C, P450DX cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1) C00001526 C00027516
1544 CYP1A2, CP12, P3-450, P450(PA) cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) C00001526 C00027516
1649 DDIT3, CEBPZ, CHOP, CHOP-10, CHOP10, GADD153 DNA-damage-inducible transcript 3 C00001526 C00027516
1965 EIF2S1, EIF-2, EIF-2A, EIF-2alpha, EIF2, EIF2A eukaryotic translation initiation factor 2, subunit 1 alpha, 35kDa C00001526 C00027516
2034 EPAS1, ECYT4, HIF2A, HLF, MOP2, PASD2, bHLHe73 endothelial PAS domain protein 1 C00001526 C00027516
26585 GREM1, CKTSF1B1, DAND2, DRM, GREMLIN, IHG-2 gremlin 1, DAN family BMP antagonist C00001526 C00027516
3309 HSPA5, BIP, GRP78, MIF2 heat shock 70kDa protein 5 (glucose-regulated protein, 78kDa) C00001526 C00027516
5594 MAPK1, ERK, ERK2, ERT1, MAPK2, P42MAPK, PRKM1, PRKM2, p38, p40, p41, p41mapk mitogen-activated protein kinase 1 (EC:2.7.11.24) C00001526 C00027516
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) C00001526 C00027516
55867 SLC22A11, OAT4, hOAT4 solute carrier family 22 (organic anion/urate transporter), member 11 C00001526 C00027516
9356 SLC22A6, HOAT1, OAT1, PAHT, ROAT1 solute carrier family 22 (organic anion transporter), member 6 C00001526 C00027516
9376 SLC22A8, OAT3 solute carrier family 22 (organic anion transporter), member 8 C00001526 C00027516
4086 SMAD1, BSP-1, BSP1, JV4-1, JV41, MADH1, MADR1 SMAD family member 1 C00001526 C00027516
4090 SMAD5, DWFC, JV5-1, MADH5 SMAD family member 5 C00001526 C00027516
4093 SMAD9, MADH6, MADH9, PPH2, SMAD8, SMAD8A, SMAD8B SMAD family member 9 C00001526 C00027516
7422 VEGFA, MVCD1, VEGF, VPF vascular endothelial growth factor A C00001526 C00027516
7494 XBP1, TREB5, XBP-1, XBP2 X-box binding protein 1 C00001526 C00027516

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (11)

OMIM preferred title UniProt
#600274 Frontotemporal dementia; ftd P10636
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#253300 Spinal muscular atrophy, type i; sma1 Q16637
#253550 Spinal muscular atrophy, type ii; sma2 Q16637
#253400 Spinal muscular atrophy, type iii; sma3 Q16637
#271150 Spinal muscular atrophy, type iv; sma4 Q16637
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636

KEGG DISEASE (12)

KEGG name UniProt
H00033 Adrenal carcinoma O00255 (related)
H00034 Carcinoid O00255 (related)
H00045 Malignant islet cell carcinoma O00255 (related)
H00246 Primary hyperparathyroidism O00255 (related)
H01102 Pituitary adenomas O00255 (related)
H00036 Osteosarcoma P08684 (marker)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (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)
H00455 Spinal muscular atrophy (SMA) Q16637 (related)

Diseases related to CTD interactions

10 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D001284 Atrophy C00001526
C00027516
D001449 Balkan Nephropathy C00001526
C00027516
D018376 Cardiovascular Abnormalities C00001526
C00027516
D007249 Inflammation C00001526
C00027516
D007674 Kidney Diseases C00001526
C00027516
D007680 Kidney Neoplasms C00001526
C00027516
D007683 Kidney Tubular Necrosis, Acute C00001526
C00027516
D009369 Neoplasms C00001526
C00027516
D051437 Renal Insufficiency C00001526
C00027516
D014571 Urologic Neoplasms C00001526
C00027516