KCF-S cluster No. 96 (50 metabolites)

Corresponding Phytochemical cluster No. 26



Metabolite list (50)

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
C00002880 External link 512 4,4'-Dihydroxy-3,5-dimethoxybibenzyl
C00002891 External link 512 3'-O-Methylbatatasin III
CHEMBL477124
C00015205 External link 512 Cirrhopetalidin
/ 2',3-Dihydroxy-3'-methoxy-4,5-methylenedioxybibenzyl
C00015206 External link 512 Combretastatin B2
C00015208 External link 512 Cirrhopetalidinin
/ 2',3-Dihydroxy-5'-methoxy-4,5-methylenedioxybibenzyl
C00015270 External link 512 Batatasin V
/ 2'-Hydroxy-3,4,5-trimethoxybibenzyl
C00015282 External link 512 3,3',5-Trimethoxybibenzyl
/ Batatasin III dimethyl ether
CHEMBL444998
C00015289 External link 512 3,3'-Dihydroxy-4,5-dimethoxybibenzyl
C00015290 External link 512 Cirrhopetalinin
/ 3,3'-Dihydroxy-4,5-methylenedioxybibenzyl
C00015305 External link 512 Combretastatin B3
/ 3',4'-Dihydroxy-3,4,5-trimethoxybibenzyl
CHEMBL485822
C056668
C00015306 External link 512 3,4'-Dihydroxy-3',4,5-trimethoxybibenzyl
C00015307 External link 512 3,4'-Dihydroxy-3',5,5'-trimethoxybibenzyl
C00015308 External link 512 3',4-Dihydroxy-3,5'-dimethoxybibenzyl
CHEMBL219553
1 / 1 / 0
C00015309 External link 512 Aloifol I
/ 3',4-Dihydroxy-3,5-dimethoxybibenzyl
C00015310 External link 512 Combretastatin B4
/ 3,4-Dihydroxy-3',5'-dimethoxybibenzyl
CHEMBL487612
C056667
C00015313 External link 512 3,4'-Dihydroxy-4,5-dimethoxybibenzyl
C00015314 External link 512 Dendrobin A
CHEMBL216090
C00015321 External link 512 3,4'-Dimethoxybibenzyl
/ Lunularine dimethyl ether
CHEMBL477915
C00015398 External link 512 3,5-Dimethoxy-2'-hydroxybibenzyl
CHEMBL228127
2 / 0 / 3
C00015399 External link 512 3,5-Dimethoxybibenzyl
/ Dihydropinosylvin dimethyl ether
C00015431 External link 512 3-Hydroxy-3'-methoxy-4,5-methylenedioxybibenzyl
C00015433 External link 512 3-Hydroxy-4,3'-dimethoxybibenzyl
C00015434 External link 512 3-Hydroxy-4,5-methylenedioxybibenzyl
C00015524 External link 512 3'-Methoxy-3,4-methylenedioxybibenzyl
C00015525 External link 512 Dihydrognetin
/ 4'-Methoxy-3,4-methylenedioxybibenzyl
CHEMBL1994199
C00015530 External link 512 Aloifol II
/ Moscatilin
/ 4,4'-Dihydroxy-3,3',5-trimethoxybibenzyl
CHEMBL374047
C071845
C00015538 External link 512 4,5-Dimethoxy-3,3',4'-trihydroxybibenzyl
C00015552 External link 512 4'-Hydroxy-3,3'-dimethoxy-4,5-methylenedioxybibenzyl
C00015553 External link 512 4'-Hydroxy-3,4,5-trimethoxybibenzyl
CHEMBL313688
C473620
C00015557 External link 512 4'-Hydroxy-5-methoxy-3,4-methylenedioxybibenzyl
C00015569 External link 512 5,3'-Dimethoxy-3,4-methylenedioxybibenzyl
C00015744 External link 512 Batatasin II
C00015795 External link 512 Isonotholaenic acid
CHEMBL68178
C00015828 External link 512 Notholaenic acid
C00015839 External link 512 Pellepiphyllin
/ 2-Hydroxy-3,4'-dimethoxybibenzyl
C00029512 External link 512 3-Methylgigantol
/ 3-O-Methylgigantol
CHEMBL525620
C00030387 External link 512 Gigantol
CHEMBL426871
C478099
C00031001 External link 512 Pholidotol A
/ 2,3'-Dihydroxy-5-methoxy-3,4-methylenedioxydihydrostilbene
C00035753 External link 512 Stilbostemin D
CHEMBL462852
C00035754 External link 512 Stilbostemin E
CHEMBL464236
C00035755 External link 512 Stilbostemin G
CHEMBL481450
C00037031 External link 512 Densiflorol A
CHEMBL1796012
1 / 1 / 0
C00038437 External link 512 Amoenylin
CHEMBL1098117
C00039427 External link 512 Isoamoenylin
CHEMBL313688
C00040639 External link 512 Virolane
C00040640 External link 512 Virolanol C
C00043109 External link 512 Vittarin A
C00045707 External link 512 Broussonin E
CHEMBL464472
1 / 2 / 2
C00045708 External link 512 Broussonin F
C00046430 External link 512 Stilbostemin F
CHEMBL464292

Human Protein / Gene in interactions

4 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
P62158 Calmodulin Unclassified protein C00015308 C00037031 1 / 0
P23219 Prostaglandin G/H synthase 1 Oxidoreductase C00015398 0 / 0
P35354 Prostaglandin G/H synthase 2 Oxidoreductase C00015398 0 / 3
P11511 Cytochrome P450 19A1 Cytochrome P450 19A1 C00045707 2 / 2

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (3)

OMIM preferred title UniProt
#613546 Aromatase deficiency P11511
#139300 Aromatase excess syndrome; aexs P11511
#614916 Ventricular tachycardia, catecholaminergic polymorphic, 4; cpvt4 P62158

KEGG DISEASE (5)

KEGG name UniProt
H00599 46,XX disorders of sex development (Disorders related to androgen excess) P11511 (related)
H00794 Aromatase excess syndrome P11511 (related)
H00017 Esophageal cancer P35354 (related)
H00025 Penile cancer P35354 (related)
H00046 Cholangiocarcinoma P35354 (related)