Metabolite list (338)

KNApSAcK ID name ChEMBL link CTD link # of proteins in
ChEMBL interaction
/ related OMIM
/ related KEGG DISEASE
# of genes in
CTD interaction
/ related diseases
KCF-S
cluster
figure
C00010791 External link 512 Globularin
No. 56
C00029570 External link 512 6'-O-Z-p-Methoxycinnamoylharpagide
/ (-)-6'-O-Z-p-Methoxycinnamoylharpagide
CHEMBL518566
CHEMBL465250
CHEMBL596187
No. 56
C00029571 External link 512 8-O-E-p-Methoxycinnamoylharpagide
CHEMBL457074
CHEMBL464666
No. 56
C00048994 External link 512 (+)-Menthofuran
/ (R)-(+)-Menthofuran
CHEMBL1522900
10 / 8 / 9 No. 56
C00010657 External link 512 Feretoside
/ Scandoside methyl ester
/ 6beta-Hydroxygeniposide
CHEMBL463096
CHEMBL516850
No. 56
C00044503 External link 512 (-)-cis,trans-Nepetalactone
No. 56
C00033295 External link 512 Picroside III
No. 56
C00029704 External link 512 8-Feruloylharpagide
/ 8-O-Feruloylhapagide
No. 56
C00010745 External link 512 Gardaloside
/ (-)-Gardaloside
No. 56
C00010744 External link 512 Tarennoside
CHEMBL482603
No. 56
C00033296 External link 512 Minecoside
CHEMBL2059079
No. 56
C00043217 External link 512 cis,cis-Nepetalactone
No. 56
C00003077 External link 512 Sesamoside
CHEMBL2048637
C099471
No. 56
C00043045 External link 512 Globularifolin
No. 56
C00042991 External link 512 Melampyroside
/ (-)-Melampyroside
No. 56
C00029978 External link 512 Harpagoside
CHEMBL516702
CHEMBL464888
CHEMBL1525311
C033249
11 / 5 / 8 No. 56
C00003081 External link 512 6beta-Hydroxyadoxoside
/ [1S-(1alpha,4aalpha,5alpha,7alpha,7aalpha)]-1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexsahydro-5-hydroxy-7-(hydroxymethyl)-methyl ester
No. 56
C00042396 External link 512 Agnuside
/ Buddlejoside A
CHEMBL391454
CHEMBL483223
1 / 0 / 0 No. 56
C00042395 External link 512 6-O-(4-hydroxybenzoyl)-6-epiaucubin
CHEMBL2332357
1 / 0 / 0 No. 56
C00003084 External link 512 Deoxyloganin
CHEMBL2048533
No. 56
C00010630 External link 512 Boschniaside
No. 56
C00040852 External link 512 Eustoside
No. 56
C00003088 External link 512 5-Deoxypulchelloside I
CHEMBL492202
CHEMBL1980462
No. 56
C00010628 External link 512 Strictoside
No. 56
C00040760 External link 512 Eustomoroside
/ Eustomorusside
No. 56
C00010779 External link 512 Monotropein
No. 56
C00010658 External link 512 Deacetylasperulosidic acid ethyl ester
No. 56
C00010618 External link 512 5-Deoxylamiol
No. 56
C00038286 External link 512 Boonein
No. 56
C00038026 External link 512 Boschnialactone
No. 56
C00010667 External link 512 Paederosidic acid methyl ester
No. 56
C00010605 External link 512 Caryoptosidic acid
/ (-)-Caryoptosidic acid
No. 56
C00010668 External link 512 Geniposide
CHEMBL462894
CHEMBL1417490
CHEMBL1718933
C007835
3 / 2 / 3 3 / 0 No. 56
C00031802 External link 512 Boucheoside
No. 56
C00037621 External link 512 Iridomyrmecin
No. 56
C00003102 External link 512 Ipolamiidoside
No. 56
C00010601 External link 512 Adoxosidic acid
No. 56
C00010473 External link 512 Phlorigidoside B
/ (-)-Phlorigidoside B
No. 56
C00010474 External link 512 Acetylbarlerin
No. 56
C00010598 External link 512 Deoxyloganic acid
No. 56
C00010597 External link 512 6beta-Dihydrocornic acid
No. 56
C00010595 External link 512 8-Epiloganic acid
/ 8-epi-Loganic acid
CHEMBL1081585
CHEMBL1079678
CHEMBL1356464
CHEMBL1452775
6 / 8 / 7 No. 56
C00031809 External link 512 Lamiidoside
No. 56
C00010482 External link 512 Cornin
/ Verbenalin
CHEMBL1080178
CHEMBL1375107
C000511
5 / 9 / 10 No. 56
C00010669 External link 512 Gardoside methyl ester
No. 56
C00031810 External link 512 Duranterectoside C
No. 56
C00037620 External link 512 Dihydronepetalactone
No. 56
C00035981 External link 512 Sorbifolivaltrate B
CHEMBL399282
No. 56
C00010590 External link 512 7-Chlorodeutziol
No. 56
C00010550 External link 512 8-epi-Muralioside
/ (-)-8-epi-Muralioside
No. 56
C00037566 External link 512 Epivogeloside
No. 56
C00037534 External link 512 Vogeloside
No. 56
C00010685 External link 512 Paederoside
CHEMBL517133
No. 56
C00037513 External link 512 Adinoside C
/ (-)-Adinoside C
No. 56
C00010580 External link 512 Deutzioside
/ Mentzeloside
/ 5-Deoxyscabroside
No. 56
C00010579 External link 512 6-Deoxycatalpol
No. 56
C00010578 External link 512 Catalpol
CHEMBL513223
C078040
2 / 1 / 1 0 / 2 No. 56
C00037090 External link 512 Secologanin
CHEMBL1235867
CHEMBL1971881
C021086
1 / 0 / 0 No. 56
C00037089 External link 512 Secologanol
No. 56
C00037088 External link 512 Valtrate hydrine B8
No. 56
C00036667 External link 512 Jatamanvaltrate I
/ (-)-Jatamanvaltrate I
CHEMBL551298
No. 56
C00010576 External link 512 Galiridoside
No. 56
C00010573 External link 512 Macfadienoside
No. 56
C00010570 External link 512 Procumbide
CHEMBL364464
No. 56
C00010687 External link 512 10-Acetylmonomelittoside
No. 56
C00010690 External link 512 10-Acetylaucubin
No. 56
C00010691 External link 512 [1S-(1alpha,4aalpha,7aalpha)]-7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
CHEMBL1078435
No. 56
C00010696 External link 512 Deacetylasperulosidic acid
CHEMBL459415
No. 56
C00010692 External link 512 Geniposidic acid
CHEMBL460031
C058966
No. 56
C00010555 External link 512 Cynanchoside
No. 56
C00010589 External link 512 Stilbericoside
No. 56
C00010534 External link 512 Physoside
No. 64
C00010537 External link 512 Stegioside III
No. 64
C00010538 External link 512 Paulownioside
No. 64
C00010539 External link 512 Asystasioside E
No. 64
C00010540 External link 512 Scabrosidol
No. 64
C00036609 External link 512 Sorbifolivaltrate D
CHEMBL273967
No. 64
C00036595 External link 512 1-Homoisoacevaltrate
/ (+)-1-Homoisoacevaltrate
No. 64
C00010693 External link 512 10-Deoxygeniposidic acid
No. 64
C00010548 External link 512 Gluroside
No. 64
C00010549 External link 512 Avicennioside
No. 64
C00010694 External link 512 Gardoside
No. 64
C00010695 External link 512 Scandoside
CHEMBL459415
No. 64
C00036611 External link 512 Valtrate hydrine B7
CHEMBL251910
No. 64
C00010701 External link 512 Theveside
No. 64
C00036651 External link 512 Jatamanvaltrate K
/ (+)-Jatamanvaltrate K
CHEMBL551356
No. 64
C00010518 External link 512 Ajugoside
CHEMBL605532
C477173
No. 64
C00010569 External link 512 Lamiol
No. 64
C00010517 External link 512 6-Deoxylamioside
No. 64
C00010572 External link 512 Antirrinoside
/ (-)-Antirrinoside
CHEMBL364464
No. 64
C00036652 External link 512 Sorbifolivaltrate C
No. 64
C00010574 External link 512 Virginioside
No. 64
C00010575 External link 512 4-Methylantirrhinoside
No. 64
C00036663 External link 512 Valtrate hydrine B3
CHEMBL401206
No. 64
C00010686 External link 512 Deacetylasperuloside
/ Deacetyl asperuloside
CHEMBL462113
No. 64
C00037307 External link 512 Secologanin dimethyl acetal
/ (-)-Secologanin dimethyl acetal
CHEMBL464473
No. 64
C00010509 External link 512 Mollugoside
No. 64
C00010508 External link 512 Citrifoside
/ (-)-Citrifoside
No. 64
C00010506 External link 512 10-Dehydrogardenoside
No. 64
C00010678 External link 512 7,8-Didehydropenstemoside
/ (-)-7,8-Didehydropenstemoside
CHEMBL517923
CHEMBL2048532
No. 64
C00010503 External link 512 Strictoloside
No. 64
C00010710 External link 512 6-O-epi-Acetylscandoside
/ (-)-6-O-epi-Acetylscandoside
No. 64
C00010677 External link 512 Theviridoside
/ Theveside methyl ester
No. 64
C00010501 External link 512 8-Epihastatoside
No. 64
C00035976 External link 512 Seneciovaltrate
CHEMBL401162
No. 64
C00010495 External link 512 10-Hydroxycornin
/ (-)-10-Hydroxycornin
No. 64
C00010480 External link 512 Alpigenoside
No. 64
C00010596 External link 512 6alpha-Dihydrocornic acid
No. 64
C00010478 External link 512 Myxopyroside
No. 64
C00010475 External link 512 6alpha-Hydroxyforsythide dimethyl ester
No. 64
C00010599 External link 512 8-Epideoxyloganic acid
No. 64
C00010600 External link 512 7-Deoxyloganic acid
C468757
No. 64
C00010472 External link 512 Phlorigidoside A
/ (-)-Phlorigidoside A
No. 64
C00010602 External link 512 Unedide
No. 64
C00010722 External link 512 Secologanoside 7-methyl ester
No. 64
C00010604 External link 512 Mussaenosidic acid
No. 64
C00037841 External link 512 Onikulactone
No. 64
C00010613 External link 512 Forsythide 8-methyl ester
No. 64
C00010614 External link 512 7-O-Acetyl-8-epi-loganic acid
/ (-)-7-O-Acetyl-8-epi-loganic acid
No. 64
C00035150 External link 512 6-O-(4-Methoxybenzoyl)-ajugol
/ (-)-6-O-(4-Methoxybenzoyl)-ajugol
No. 64
C00031598 External link 512 7-O-(4-Hydroxybenzoyl)tecomoside
No. 64
C00034480 External link 512 Isovanilloylcatalpol
CHEMBL1989040
CHEMBL2059077
No. 64
C00010729 External link 512 Aucubin
CHEMBL514882
CHEMBL1873725
CHEMBL1874462
C006650
5 / 1 / 1 No. 64
C00010659 External link 512 Daphylloside
/ Asperulosidic acid methyl ester
No. 64
C00030588 External link 512 Picroside IV
No. 64
C00034066 External link 512 Myobontioside B
/ (-)-Myobontioside B
No. 64
C00030587 External link 512 Harprocumbide B
No. 64
C00010629 External link 512 Mongolioside
/ Decapetaloside
No. 64
C00040911 External link 512 10-O-vanillate
/ (-)-Pedunculariside
/ 10-o-Vanilloyl aucubin
No. 64
C00010634 External link 512 Cachineside V
No. 64
C00033820 External link 512 6-Feruloylcatalpol
No. 64
C00003075 External link 512 Ipolamiide
No. 64
C00003071 External link 512 Mussaenoside
CHEMBL2355776
1 / 1 / 1 No. 64
C00029601 External link 512 8-O-Z-p-Methoxycinnamoylharpagide
/ (-)-8-O-Z-p-Methoxycinnamoylharpagide
CHEMBL457074
CHEMBL464666
No. 64
C00010649 External link 512 Tecomoside
No. 64
C00049966 External link 512 Fulvoplumierin
CHEMBL445545
C017333
No. 64
C00032672 External link 512 Decumbeside C
No. 100
C00010644 External link 512 Yuheinoside
/ Plantarenaloside
No. 100
C00010620 External link 512 Kankanoside A
/ (-)-Kankanoside A
No. 100
C00010619 External link 512 Suspensoside A
No. 100
C00034978 External link 512 Veronicoside
No. 100
C00010603 External link 512 Shanzhiside
CHEMBL518392
No. 100
C00035959 External link 512 Piscroside A
/ (-)-Piscroside A
No. 100
C00036118 External link 512 Sorbifolivaltrate A
CHEMBL401856
No. 100
C00010582 External link 512 Scabroside
No. 100
C00010679 External link 512 Asperuloside
CHEMBL461910
CHEMBL1965021
C077956
1 / 0 / 0 No. 100
C00036396 External link 512 Acevaltrate
/ Acetovaltrate
/ Acetoxyvaltrate
CHEMBL563350
C090810
No. 100
C00010577 External link 512 6-O-Methylcatalpol
CHEMBL1608702
CHEMBL1779143
1 / 0 / 0 No. 100
C00010565 External link 512 Harpagide
CHEMBL430183
C033250
1 / 0 / 3 No. 100
C00010564 External link 512 Euphroside
No. 100
C00036513 External link 512 1-Homoacevaltrate
No. 100
C00010556 External link 512 Linarioside
No. 100
C00010547 External link 512 Kankanoside B
/ (-)-Kankanoside B
No. 100
C00010533 External link 512 Stryspinoside
/ (-)-Stryspinoside
No. 100
C00010532 External link 512 Diderroside
No. 100
C00036616 External link 512 10-Acetoxy-1-homovaltrate hydrin
/ (+)-10-Acetoxy-1-homovaltrate hydrin
No. 100
C00036635 External link 512 Jatamanvaltrate J
/ (+)-Jatamanvaltrate J
CHEMBL560617
No. 100
C00010709 External link 512 Ixoside
CHEMBL498244
No. 100
C00037568 External link 512 Sweroside
CHEMBL456137
C049412
1 / 0 / 0 No. 100
C00010496 External link 512 Griselinoside
No. 100
C00010481 External link 512 Ketologanin
/ Dehydrologanin
No. 100
C00037800 External link 512 (4R)-4-Hydroxymethylboschnialactone
No. 100
C00031721 External link 512 Durantoside II
No. 100
C00010717 External link 512 6-epi-Paederosidic acid
/ (-)-6-epi-Paederosidic acid
CHEMBL518786
No. 100
C00010719 External link 512 Secologanic acid
No. 100
C00010720 External link 512 Secologanoside
No. 100
C00037801 External link 512 Mitsugashiwalactone
No. 100
C00003097 External link 512 Phlorigidoside C
/ (-)-Phlorigidoside C
CHEMBL2048531
No. 100
C00003094 External link 512 Secogaliosdie
No. 100
C00038314 External link 512 11-Homohydroxyldihydrovaltrate
/ (-)-11-Homohydroxyldihydrovaltrate
No. 100
C00003089 External link 512 Pulchelloside I
CHEMBL1995139
No. 100
C00030094 External link 512 Laterioside
/ (-)-Laterioside
/ 8-Cinnamoylmyoporoside
/ (-)-8-Cinnamoylmyoporoside
No. 100
C00030093 External link 512 Harpagoside B
/ (-)-Harpagoside B
No. 100
C00030092 External link 512 Z-Harpagoside
CHEMBL516702
CHEMBL464888
CHEMBL1525311
11 / 5 / 8 No. 100
C00042538 External link 512 Davisioside
/ (-)-Davisioside
No. 100
C00029749 External link 512 8-O-(p-Coumaroyl)-harpagide
CHEMBL513852
No. 100
C00043989 External link 512 trans-cis-Nepetalactone
No. 100
C00003073 External link 512 6beta-Hydroxyipolamiide
No. 100
C00003072 External link 512 Shanzhiside methyl ester
CHEMBL1081414
1 / 1 / 1 No. 100
C00045189 External link 512 Isoplumericin
CHEMBL463014
CHEMBL517300
No. 100
C00049144 External link 512 (+)-Neomatatabiol
No. 100
C00049601 External link 512 Genipin
CHEMBL459016
CHEMBL1317787
C007834
6 / 3 / 2 3 / 1 No. 100
C00032106 External link 512 Durantoside 1
No. 100
C00000320 External link 512 Penstemoside
/ Pedicularioside
CHEMBL463960
C079206
No. 100
C00010507 External link 512 Apodantheroside
No. 120
C00010516 External link 512 Reptoside
CHEMBL518538
No. 120
C00010512 External link 512 Secologanoside dimethyl ester
No. 120
C00010511 External link 512 Randioside
No. 120
C00021691 External link 512 Globularimin
No. 120
C00021692 External link 512 Globularioside
No. 120
C00021693 External link 512 Globularidin
No. 120
C00021694 External link 512 Piscroside B
/ (-)-Piscroside B
No. 120
C00024025 External link 512 Picroroside A
/ (-)-Picroroside A
No. 120
C00024026 External link 512 Scutellarioside
No. 120
C00024027 External link 512 Specioside
/ (-)-Specioside
CHEMBL2332355
1 / 0 / 0 No. 120
C00046537 External link 512 Allamcin
/ (+)-Allamcin
CHEMBL487610
C068510
No. 120
C00010510 External link 512 Apodanthoside
No. 120
C00045596 External link 512 Specionin
No. 120
C00045595 External link 512 (-)-3'-Methoxy specinonin
No. 120
C00045583 External link 512 Piscrocin G
/ (-)-Piscrocin G
No. 120
C00045582 External link 512 Piscrocin F
/ (-)-Piscrocin F
No. 120
C00010591 External link 512 Angeloside
No. 120
C00010592 External link 512 Loganic acid
CHEMBL1081585
CHEMBL1079678
CHEMBL1356464
CHEMBL1452775
C002947
6 / 8 / 7 No. 120
C00010593 External link 512 Epiloganic acid
CHEMBL1081585
CHEMBL1079678
CHEMBL1356464
CHEMBL1452775
6 / 8 / 7 No. 120
C00010594 External link 512 7-Epiloganic acid
CHEMBL1081585
CHEMBL1079678
CHEMBL1356464
CHEMBL1452775
6 / 8 / 7 No. 120
C00010505 External link 512 Gardenoside
CHEMBL485798
CHEMBL1079679
CHEMBL1482711
CHEMBL2133850
C056587
14 / 2 / 5 No. 120
C00030408 External link 512 6'-O-(p-Coumaroyl)-procumbide
No. 120
C00003083 External link 512 Adoxoside
/ Dihydrogeniposide
No. 120
C00040950 External link 512 Buddlejoside B
/ (-)-Buddlejoside B
No. 120
C00031028 External link 512 Decumbeside A
No. 120
C00035147 External link 512 6-O-(4-Hydroxybenzoyl)-ajugol
No. 120
C00040902 External link 512 Swertiamarin
CHEMBL456138
C013270
1 / 0 / 0 No. 120
C00035110 External link 512 6-O-(4-Hydroxybenzoyl)-ajugol
No. 120
C00035034 External link 512 10-O-Benzoylcatalpol
/ (-)-10-O-Benzoylcatalpol
No. 120
C00031044 External link 512 Pondraneoside
No. 120
C00010504 External link 512 Galioside
CHEMBL485798
CHEMBL1079679
CHEMBL1482711
CHEMBL2133850
14 / 2 / 5 No. 120
C00034975 External link 512 Catalposide
CHEMBL2332354
C006928
1 / 0 / 0 No. 120
C00034896 External link 512 Verproside
CHEMBL1082144
CHEMBL1979513
No. 120
C00034894 External link 512 6-O-Veratroylcatalpol
CHEMBL2059078
No. 120
C00010714 External link 512 Paederosidic acid
CHEMBL518786
No. 120
C00010713 External link 512 O-Acetylgeniposidic acid
/ 10-O-Acetylgeniposidic acid
No. 120
C00010712 External link 512 Asperulosidic acid
CHEMBL389958
No. 120
C00010711 External link 512 6-O-Acetylscandoside
No. 120
C00010652 External link 512 6alpha-Hydroxygeniposide
/ Methyl deacetylasperulosidate
/ Deacetylasperulosidic acid methyl ester
CHEMBL463096
CHEMBL516850
No. 120
C00010502 External link 512 Aralidioside
No. 120
C00010650 External link 512 Dihydrocatalpol
CHEMBL471185
No. 120
C00039336 External link 512 Didrovaltratum
CHEMBL550227
C024750
No. 120
C00010522 External link 512 Eleganoside B
No. 287
C00010514 External link 512 8-Acetylharpagide
/ Harpagide 7-acetate
/ 8-O-Acetylharpagide
CHEMBL523290
CHEMBL595293
C077626
1 / 2 / 0 No. 287
C00010515 External link 512 Lamioside
No. 287
C00033579 External link 512 6-Feruloyl ajugol
/ 6-O-(E)-Feruloyl ajugol
No. 287
C00038309 External link 512 Isoboonein
/ (+)-Isoboonein
CHEMBL495275
No. 287
C00010520 External link 512 Eleganoside A
No. 287
C00034067 External link 512 Picroside II
/ Vanilloyl catalpol
CHEMBL510404
C416837
1 / 0 / 0 0 / 1 No. 287
C00034409 External link 512 Amphicoside
CHEMBL510404
1 / 0 / 0 No. 287
C00032594 External link 512 Durantoside III
No. 287
C00034556 External link 512 Kutkoside
No. 287
C00010521 External link 512 Eleganoside C
No. 287
C00010513 External link 512 Adinoside A
No. 287
C00010524 External link 512 Gonocaryoside E
/ (-)-Gonocaryoside E
No. 287
C00035964 External link 512 Dihomovaltrate
No. 287
C00031043 External link 512 Cachineside III
No. 287
C00035963 External link 512 Valtrate
/ Valtratum
CHEMBL402061
C030127
No. 287
C00031030 External link 512 Decumbeside B
No. 287
C00003076 External link 512 Phlomiol
CHEMBL2048638
CHEMBL2048639
C099472
No. 287
C00035962 External link 512 Isovaltrate
CHEMBL249657
No. 287
C00035233 External link 512 6-O-(3,4-dimethoxybenzoyl)-ajugol
No. 287
C00044068 External link 512 trans,trans-Nepetalactone
No. 287
C00035510 External link 512 Pikuroside
/ (-)-Pikuroside
No. 287
C00035234 External link 512 6-O-(3,4,5-trimethoxybenzoyl)-ajugol
No. 287
C00040333 External link 512 Jatamanvaltrate H
/ (-)-Jatamanvaltrate H
CHEMBL559515
No. 433
C00040620 External link 512 5-Deoxyeustomoside
No. 433
C00040619 External link 512 Eustomoside
No. 433
C00045502 External link 512 Plumericin
CHEMBL463014
CHEMBL517300
C068511
No. 433
C00045526 External link 512 Allamandicin
CHEMBL1996534
No. 433
C00045527 External link 512 beta-Dihydroplumericin
No. 433
C00010581 External link 512 Unedoside
No. 433
C00045855 External link 512 Allamandin
CHEMBL519742
C006451
No. 433
C00047472 External link 512 Hedyotoside
No. 433
C00047473 External link 512 Gentioflavoside
No. 433
C00040336 External link 512 Brasoside
No. 433
C00040335 External link 512 Jatamanvaltrate M
/ (-)-Jatamanvaltrate M
CHEMBL563802
No. 433
C00010724 External link 512 6-Epiaucubin
CHEMBL514882
CHEMBL1873725
CHEMBL1874462
5 / 1 / 1 No. 433
C00003101 External link 512 8-O-Acetylmussaenoside
No. 433
C00047474 External link 512 Gentiopicrin
/ Gentiopicroside
CHEMBL508320
C012997
2 / 2 / 0 0 / 1 No. 433
C00040334 External link 512 Didrovaltrate acetoxy hydrin
CHEMBL560620
No. 433
C00040277 External link 512 Jatamanvaltrate G
/ (-)-Jatamanvaltrate G
CHEMBL559514
No. 433
C00040618 External link 512 [2aR-(2aalpha,3beta,4alpha,7balpha)]-3-(beta-D-Gucopyranosyloxy)-2a,3,4,4a,5,7b-hexahydro-4a-hydroxy-4-methyl-1H-2,6-dioxacyclopent[cd]inden-1-one
No. 433
C00031346 External link 512 Campsiside
No. 806
C00044505 External link 512 Dolicholactone
No. 806
C00037112 External link 512 Secoxyloganin
C059515
No. 806
C00044504 External link 512 cis-trans-Nepetalactone
C115644
No. 806
C00010792 External link 512 Globularicisin
No. 806
C00037434 External link 512 Loniceracetalide B
/ (-)-Loniceracetalide B
No. 806
C00037435 External link 512 Adinoside B
/ (-)-Adinoside B
No. 806
C00003098 External link 512 Barlerin
/ (-)-Barlerin
/ 8-O-Acetylshanzhiside methyl ester
CHEMBL463751
CHEMBL463377
C099473
No. 806
C00031339 External link 512 5-Hydroxycampenoside
No. 806
C00010794 External link 512 Picroside I
CHEMBL454577
C109270
No. 806
C00010800 External link 512 Globularinin
No. 806
C00010616 External link 512 Iridoid glycoside
/ (-)-Iridoid glycoside
No. 1198
C00010617 External link 512 5-Deoxylamiol
No. 1198
C00003086 External link 512 Nyctanthoside
/ (-)-Nyctanthoside
No. 1198
C00010615 External link 512 Forsythide
No. 1198
C00003074 External link 512 Lamiide
No. 1198
C00037323 External link 512 Loniceracetalide A
/ (-)-Loniceracetalide A
No. 1198
C00010541 External link 512 Ajugol
/ Leonuride
CHEMBL595516
No. 1198
C00031464 External link 512 Campenoside
No. 1198
C00047470 External link 512 Plumieride
CHEMBL464470
C110080
No. 1308
C00047365 External link 512 Allamancin
/ (+)-Allamancin
No. 1308
C00045509 External link 512 Allamdin
No. 1308
C00047433 External link 512 beta-Allamcidin glucoside
No. 1308
C00047471 External link 512 Plumiepoxide
No. 1308
C00047476 External link 512 Evodone
No. 1308
C00003078 External link 512 8-Epiloganin
CHEMBL1081584
CHEMBL1081586
CHEMBL1589904
CHEMBL2135791
2 / 1 / 1 No. 1308
C00010747 External link 512 Tomentoside
No. 1348
C00010748 External link 512 Monomelittoside
No. 1348
C00010558 External link 512 Cachineside IV
No. 1348
C00003100 External link 512 6-O-Acetylshanzhiside methyl ester
CHEMBL2048640
No. 1348
C00010746 External link 512 Hygrophiloside
No. 1348
C00010749 External link 512 Teuhircoside
No. 1348
C00010500 External link 512 Hastatoside
No. 1348
C00033187 External link 512 Verminoside
/ (-)-Verminoside
CHEMBL462888
1 / 0 / 0 No. 1380
C00035232 External link 512 6-O-Vanilloyl-ajugol
/ (-)-6-O-Vanilloyl-ajugol
CHEMBL1779142
No. 1380
C00010624 External link 512 Deutziol
No. 1380
C00003068 External link 512 Genameside B
No. 1380
C00038657 External link 512 5-Hydroxydidrovaltrate
CHEMBL556884
No. 1380
C00029374 External link 512 6'-O-E-p-Methoxycinnamoylharpagide
/ (-)-6'-O-E-p-Methoxycinnamoylharpagide
CHEMBL518566
CHEMBL465250
CHEMBL596187
No. 1380
C00032890 External link 512 Decumbeside D
No. 1380
C00003092 External link 512 Morroniside
CHEMBL1209803
CHEMBL2136065
CHEMBL2152455
1 / 0 / 0 No. 1647
C00010542 External link 512 Myobontioside A
/ (-)-Myobontioside A
No. 1647
C00003091 External link 512 alpha-Morroniside
CHEMBL1209803
CHEMBL2136065
CHEMBL2152455
1 / 0 / 0 No. 1647
C00010639 External link 512 Cachineside I
No. 1647
C00010638 External link 512 Ixoroside
No. 1647
C00010640 External link 512 Stansioside
No. 1647
C00003087 External link 512 Yopaaoside C
/ (-)-Yopaaoside C
No. 2035
C00010735 External link 512 Antirride
/ Antirrhide
No. 2035
C00003095 External link 512 Citrifolinin B epimer a
CHEMBL518691
CHEMBL517315
No. 2035
C00010737 External link 512 6beta-Hydroxyantirrhide
No. 2035
C00010731 External link 512 Loasaside
No. 2035
C00031041 External link 512 7-O-(4-Methoxycinnamoyl)tecomoside
No. 2814
C00029275 External link 512 Stereospermoside
/ (-)-Stereospermoside
CHEMBL2332358
1 / 0 / 0 No. 2814
C00031042 External link 512 7-O-(4-hydroxycinnamoyl)tecomoside
No. 2814
C00003099 External link 512 6,9-Epi-8-O-acetylshanziside methyl ester
/ (-)-6,9-Epi-8-O-acetylshanziside methyl ester
CHEMBL463751
CHEMBL463377
No. 2814
C00010734 External link 512 Bartsioside
No. 3369
C00003069 External link 512 Caryoptoside
No. 3369
C00010730 External link 512 Decaloside
No. 3369
C00010740 External link 512 3,4-Dihydroaucubin
No. 3715
C00010733 External link 512 Linaride
No. 3715
C00003096 External link 512 Citrifolinin B epimer b
CHEMBL518691
CHEMBL517315
No. 3715
C00003082 External link 512 6alpha-Hydroxyadoxoside
No. 3781
C00049175 External link 512 Dolichodial
No. 3781
C00010753 External link 512 Eranthemoside
No. 3781
C00003044 External link 512 Phlomoside A
/ (-)-Phlomoside A
No. 5653
C00003049 External link 512 Genameside A
/ (-)-Genameside A
No. 5653
C00003090 External link 512 Lamalbid
/ Lamalbide
/ Lamiridoside
CHEMBL1079619
CHEMBL2048642
No. 5907
C00003079 External link 512 Loganin
CHEMBL1081584
CHEMBL1081586
CHEMBL1589904
CHEMBL2135791
C059516
2 / 1 / 1 0 / 1 No. 6995
C00000321 External link 512 5,9-epi-Penstemoside
/ (-)-5,9-epi-Penstemoside
CHEMBL463960
No. 8306
C00003080 External link 512 Penstemonoside
CHEMBL518727
C091292
No. 8921

Human Protein / Gene in interactions

43 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
O75496 Geminin Unclassified protein C00000320 C00000321 C00003073 C00003081 C00003083 C00003088 C00003100 C00010779 C00031802 C00035981 C00036616 C00037513 C00046537 0 / 0
P83916 Chromobox protein homolog 1 Unclassified protein C00000321 C00003072 C00003073 C00003081 C00003082 C00003083 C00031802 C00036616 C00046537 0 / 0
P07900 Heat shock protein HSP 90-alpha Other cytosolic protein C00003076 C00003098 C00010514 C00010521 C00010794 C00034409 C00034894 C00034896 C00035232 0 / 0
P60033 CD81 antigen Unclassified protein C00000321 C00003088 C00010604 C00010687 C00029601 C00033820 C00035981 C00036652 1 / 1
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein C00003082 C00003102 C00010570 C00010604 C00029601 C00033820 C00036652 2 / 0
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00003049 C00010604 C00029601 C00033820 C00036652 0 / 0
P10636 Microtubule-associated protein tau Unclassified protein C00003102 C00010604 C00029601 C00033820 C00036652 4 / 3
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme C00000321 C00010604 C00029601 C00033820 C00036652 1 / 0
Q9UBT6 DNA polymerase kappa Enzyme C00003073 C00003081 C00031802 C00036616 0 / 0
P01215 Glycoprotein hormones alpha chain Unclassified protein C00010604 C00029601 C00033820 C00036652 0 / 3
P00352 Retinal dehydrogenase 1 Enzyme C00003049 C00003083 C00046537 0 / 0
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 C00003049 C00003083 C00046537 0 / 1
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 C00003049 C00003083 C00046537 1 / 1
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 C00003049 C00003083 C00046537 0 / 1
Q92830 Histone acetyltransferase KAT2A Enzyme C00003075 C00003081 C00031802 0 / 0
P16473 Thyrotropin receptor Glycohormone receptor C00003049 C00003083 C00046537 3 / 2
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 C00003049 C00003083 C00046537 1 / 0
P03372 Estrogen receptor NR3A1 C00003073 C00003075 C00036616 1 / 1
P35354 Prostaglandin G/H synthase 2 Oxidoreductase C00003083 C00010569 C00046537 0 / 3
P05177 Cytochrome P450 1A2 Cytochrome P450 1A2 C00003049 C00003083 C00046537 0 / 0
Q9Y253 DNA polymerase eta Enzyme C00003081 C00031802 1 / 1
Q9Y468 Lethal(3)malignant brain tumor-like protein 1 Unclassified protein C00003073 C00036616 0 / 0
Q9UIF8 Bromodomain adjacent to zinc finger domain protein 2B Unclassified protein C00003081 C00031802 0 / 0
Q13951 Core-binding factor subunit beta Unclassified protein C00003081 C00031802 0 / 1
Q01196 Runt-related transcription factor 1 Unclassified protein C00003081 C00031802 1 / 4
Q9UNA4 DNA polymerase iota Enzyme C00003081 C00031802 0 / 0
O75164 Lysine-specific demethylase 4A Enzyme C00003081 C00031802 0 / 0
P27695 DNA-(apurinic or apyrimidinic site) lyase Enzyme C00003081 C00031802 0 / 0
Q9GZU7 Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 Enzyme C00003081 C00031802 0 / 0
P06746 DNA polymerase beta Enzyme C00003081 C00031802 0 / 0
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00003083 C00046537 0 / 0
O94925 Glutaminase kidney isoform, mitochondrial Enzyme C00003081 C00031802 0 / 0
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00000320 C00003102 0 / 0
P10275 Androgen receptor NR3C4 C00003049 3 / 4
P39748 Flap endonuclease 1 Enzyme C00010518 0 / 0
Q8IUX4 DNA dC->dU-editing enzyme APOBEC-3F Enzyme C00000321 0 / 0
O00255 Menin Unclassified protein C00003102 2 / 5
Q03164 Histone-lysine N-methyltransferase 2A Enzyme C00003102 1 / 2
P11509 Cytochrome P450 2A6 Cytochrome P450 2A6 C00003049 0 / 0
P11473 Vitamin D3 receptor NR1I1 C00000320 2 / 3
P09917 Arachidonate 5-lipoxygenase Oxidoreductase C00003068 0 / 0
Q99700 Ataxin-2 Unclassified protein C00000321 1 / 1
Q13148 TAR DNA-binding protein 43 Unclassified protein C00010630 1 / 1

3 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
581 BAX, BCL2L4 BCL2-associated X protein C00000320 C00000321
596 BCL2, Bcl-2, PPP1R50 B-cell CLL/lymphoma 2 C00000320 C00000321
836 CASP3, CPP32, CPP32B, SCA-1 caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) C00000320 C00000321

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (26)

OMIM preferred title UniProt
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#300068 Androgen insensitivity syndrome; ais P10275
#312300 Androgen insensitivity, partial; pais P10275
#114500 Colorectal cancer; crc P84022
#609535 Drug metabolism, poor, cyp2c19-related P33261
#608902 Drug metabolism, poor, cyp2d6-related P10635
#615363 Estrogen resistance; estrr P03372
#600274 Frontotemporal dementia; ftd P10636
#137800 Glioma susceptibility 1; glm1 O75874
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#603373 Hyperthyroidism, familial gestational P16473
#609152 Hyperthyroidism, nonautoimmune P16473
#275200 Hypothyroidism, congenital, nongoitrous, 1; chng1 P16473
#613496 Immunodeficiency, common variable, 6; cvid6 P60033
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#607948 Mycobacterium tuberculosis, susceptibility to P11473
#260540 Parkinson-dementia syndrome P10636
#172700 Pick disease of brain P10636
#601399 Platelet disorder, familial, with associated myeloid malignancy Q01196
#313200 Spinal and bulbar muscular atrophy, x-linked 1; smax1 P10275
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#601104 Supranuclear palsy, progressive, 1; psnp1 P10636
#277440 Vitamin d-dependent rickets, type 2a; vddr2a P11473
#278750 Xeroderma pigmentosum, variant type; xpv Q9Y253

KEGG DISEASE (34)

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)
H00081 Hashimoto's thyroiditis P01215 (marker)
H00082 Graves' disease P01215 (marker)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P01215 (marker)
P16473 (related)
H00026 Endometrial Cancer P03372 (marker)
H00036 Osteosarcoma P08684 (marker)
H00024 Prostate cancer P10275 (related)
H00062 Spinal and bulbar muscular atrophy (SBMA) P10275 (related)
H00608 46,XY disorders of sex development (Disorders in androgen synthesis or action) P10275 (related)
H00609 46,XY disorders of sex development (Other) P10275 (related)
H00058 Amyotrophic lateral sclerosis (ALS) P10636 (related)
Q13148 (related)
H00077 Progressive supranuclear palsy (PSP) P10636 (related)
H00078 Frontotemporal lobar degeneration (FTLD) P10636 (related)
H00342 Tuberculosis P11473 (related)
H00784 Localized autosomal recessive hypotrichosis P11473 (related)
H01143 Vitamin D-dependent rickets P11473 (related)
H01205 Coumarin resistance P11712 (related)
H01269 Congenital hyperthyroidism P16473 (related)
H01171 Poor drug metabolism (PM) P33261 (related)
H00017 Esophageal cancer P35354 (related)
H00025 Penile cancer P35354 (related)
H00046 Cholangiocarcinoma P35354 (related)
H00088 Common variable immunodeficiency (CVID) P60033 (related)
H00001 Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) Q01196 (related)
Q01196 (marker)
Q03164 (related)
Q03164 (marker)
H00003 Acute myeloid leukemia (AML) Q01196 (related)
Q01196 (marker)
Q13951 (marker)
H00004 Chronic myeloid leukemia (CML) Q01196 (related)
H00978 Thrombocytopenia (THC) Q01196 (related)
H00002 Acute lymphoblastic leukemia (ALL) (precursor T lymphoblastic leukemia) Q03164 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)
H00403 Disorders of nucleotide excision repair Q9Y253 (related)

Diseases related to CTD interactions

6 disease in interactions with metabolites

MESH or OMIM name KNApSAcK
metabolite
D002779 Cholestasis C00000321
D017114 Liver Failure, Acute C00003082
D008569 Memory Disorders C00003088
D007249 Inflammation C00003075
D019636 Neurodegenerative Diseases C00003075
D056486 Drug-Induced Liver Injury C00010514