KCF-S cluster No. 1009 (9 metabolites)

Corresponding Phytochemical cluster No. 7


Plant Species


Cumulative plant class count

class name count
rosids 13
asterids 8
Liliopsida 1

Cumulative family count

class name count
Rutaceae 13
Rubiaceae 5
Loganiaceae 2
Apocynaceae 1
Amaryllidaceae 1
Notodontidae 1

KEGG BRITE br08003 External link 512


Categories (2)

br08003 Category # of metabolite
Quinoline alkaloids 1
Quinazoline alkaloids 1

metabolites link (2)

br08003 Category KEGG ID KNApSAcK ID
Quinoline alkaloids C09032 C00001685
Quinazoline alkaloids C09238 C00001766

Metabolite list (9)

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
C00001685 External link 512 Angustine
C004166
C00001766 External link 512 Rutaecarpine
CHEMBL85139
C028632
35 / 47 / 67 5 / 0
C00025154 External link 512 Angustoline
/ (-)-Angustoline
C004167
C00026551 External link 512 7-Hydroxyrutaecarpine
C00027032 External link 512 3-Hydroxyrutaecarpine
C00027710 External link 512 1-Hydroxyrutaecarpine
C00034074 External link 512 Naucleofficine E
CHEMBL1173138
C00039905 External link 512 Orisuaveoline A
CHEMBL575438
C00046191 External link 512 Nauclealine B
/ (-)-Nauclealine B

Human Protein / Gene in interactions

35 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 C00001766 1 / 0
P42345 Serine/threonine-protein kinase mTOR Enzyme C00001766 0 / 0
P04637 Cellular tumor antigen p53 Transcription Factor C00001766 7 / 37
Q16637 Survival motor neuron protein Unclassified protein C00001766 4 / 1
Q99700 Ataxin-2 Unclassified protein C00001766 1 / 1
P14618 Pyruvate kinase PKM Enzyme C00001766 0 / 0
P35354 Prostaglandin G/H synthase 2 Oxidoreductase C00001766 0 / 3
P06746 DNA polymerase beta Enzyme C00001766 0 / 0
P14780 Matrix metalloproteinase-9 M10A C00001766 2 / 2
P02545 Prelamin-A/C Unclassified protein C00001766 11 / 10
P16473 Thyrotropin receptor Glycohormone receptor C00001766 3 / 2
P04798 Cytochrome P450 1A1 Cytochrome P450 1A1 C00001766 0 / 0
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 C00001766 0 / 1
P54132 Bloom syndrome protein Enzyme C00001766 1 / 2
P23219 Prostaglandin G/H synthase 1 Oxidoreductase C00001766 0 / 0
P00352 Retinal dehydrogenase 1 Enzyme C00001766 0 / 0
Q16665 Hypoxia-inducible factor 1-alpha Transcription Factor C00001766 0 / 0
P51151 Ras-related protein Rab-9A Unclassified protein C00001766 0 / 0
P83916 Chromobox protein homolog 1 Unclassified protein C00001766 0 / 0
P11021 78 kDa glucose-regulated protein Unclassified protein C00001766 0 / 0
Q16678 Cytochrome P450 1B1 Cytochrome P450 1B1 C00001766 4 / 4
P05177 Cytochrome P450 1A2 Cytochrome P450 1A2 C00001766 0 / 0
Q99714 3-hydroxyacyl-CoA dehydrogenase type-2 Enzyme C00001766 3 / 3
O15118 Niemann-Pick C1 protein Unclassified protein C00001766 1 / 1
Q01453 Peripheral myelin protein 22 Unclassified protein C00001766 5 / 2
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00001766 0 / 0
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 C00001766 1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 C00001766 0 / 1
Q9UNA4 DNA polymerase iota Enzyme C00001766 0 / 0
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00001766 0 / 0
P08908 5-hydroxytryptamine receptor 1A Serotonin receptor C00001766 1 / 0
B2RXH2 Lysine-specific demethylase 4E Enzyme C00001766 0 / 0
P40225 Thrombopoietin Unclassified protein C00001766 1 / 1
Q96KQ7 Histone-lysine N-methyltransferase EHMT2 Enzyme C00001766 0 / 0
Q13148 TAR DNA-binding protein 43 Unclassified protein C00001766 1 / 1

5 Gene in CTD interactions

gene gene name gene description KNApSAcK metabolite in interactions
196 AHR, bHLHe76 aryl hydrocarbon receptor C00001766
57491 AHRR, AHH, AHHR, bHLHe77 aryl-hydrocarbon receptor repressor C00001766
1543 CYP1A1, AHH, AHRR, CP11, CYP1, P1-450, P450-C, P450DX cytochrome P450, family 1, subfamily A, polypeptide 1 (EC:1.14.14.1) C00001766
1544 CYP1A2, CP12, P3-450, P450(PA) cytochrome P450, family 1, subfamily A, polypeptide 2 (EC:1.14.14.1) C00001766
1545 CYP1B1, CP1B, CYPIB1, GLC3A, P4501B1 cytochrome P450, family 1, subfamily B, polypeptide 1 (EC:1.14.14.1) C00001766

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (47)

OMIM preferred title UniProt
#300438 17-beta-hydroxysteroid dehydrogenase x deficiency Q99714
#202300 Adrenocortical carcinoma, hereditary; adcc P04637
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#614740 Basal cell carcinoma, susceptibility to, 7; bcc7 P04637
#210900 Bloom syndrome; blm P54132
#115200 Cardiomyopathy, dilated, 1a; cmd1a P02545
#212112 Cardiomyopathy, dilated, with hypergonadotropic hypogonadism P02545
#118300 Charcot-marie-tooth disease and deafness Q01453
#605588 Charcot-marie-tooth disease, axonal, type 2b1; cmt2b1 P02545
#118220 Charcot-marie-tooth disease, demyelinating, type 1a; cmt1a Q01453
#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
#137750 Glaucoma 1, open angle, a; glc1a Q16678
#231300 Glaucoma 3, primary congenital, a; glc3a Q16678
#137760 Glaucoma, primary open angle; poag Q16678
#139393 Guillain-barre syndrome, familial; gbs Q01453
#610140 Heart-hand syndrome, slovenian type P02545
#176670 Hutchinson-gilford progeria syndrome; hgps P02545
#603373 Hyperthyroidism, familial gestational P16473
#609152 Hyperthyroidism, nonautoimmune P16473
#145900 Hypertrophic neuropathy of dejerine-sottas Q01453
#275200 Hypothyroidism, congenital, nongoitrous, 1; chng1 P16473
#603932 Intervertebral disc disease; idd P14780
#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
#300705 Mental retardation, x-linked 17; mrx17 Q99714
#300220 Mental retardation, x-linked, syndromic 10; mrxs10 Q99714
#613073 Metaphyseal anadysplasia 2; mandp2 P14780
#613205 Muscular dystrophy, congenital, lmna-related P02545
#159001 Muscular dystrophy, limb-girdle, type 1b; lgmd1b P02545
#162500 Neuropathy, hereditary, with liability to pressure palsies; hnpp Q01453
#257220 Niemann-pick disease, type c1; npc1 O15118
#260500 Papilloma of choroid plexus; cpp P04637
#614674 Periodic fever, menstrual cycle-dependent P08908
#604229 Peters anomaly Q16678
#275210 Restrictive dermopathy, lethal P02545
#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
#183090 Spinocerebellar ataxia 2; sca2 Q99700
#275355 Squamous cell carcinoma, head and neck; hnscc P04637
#187950 Thrombocythemia 1; thcyt1 P40225

KEGG DISEASE (67)

KEGG name UniProt
H00136 Niemann-Pick disease type C (NPC) O15118 (related)
H00264 Charcot-Marie-Tooth disease (CMT) P02545 (related)
Q01453 (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)
H00017 Esophageal cancer P04637 (related)
P04637 (marker)
P35354 (related)
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)
P14780 (related)
P35354 (related)
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)
H00033 Adrenal carcinoma 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)
P35354 (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)
H01205 Coumarin resistance P11712 (related)
H00479 Metaphyseal dysplasias P14780 (related)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P16473 (related)
H01269 Congenital hyperthyroidism P16473 (related)
H01171 Poor drug metabolism (PM) P33261 (related)
H00227 Congenital amegakaryocytic thrombocytopenia (CAMT) P40225 (marker)
H00094 DNA repair defects P54132 (related)
H00296 Defects in RecQ helicases P54132 (related)
H01296 Hereditary neuropathy with liability to pressure palsies (HNPP) Q01453 (related)
H00058 Amyotrophic lateral sclerosis (ALS) Q13148 (related)
H00455 Spinal muscular atrophy (SMA) Q16637 (related)
H00612 Primary open angle glaucoma Q16678 (related)
H01075 Peters anomaly Q16678 (related)
H01159 Anterior segment dysgenesis (ASD) Q16678 (related)
H01203 Primary congenital glaucoma (PCG) Q16678 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)
H00480 Non-syndromic X-linked mental retardation Q99714 (related)
H00658 Syndromic X-linked mental retardation Q99714 (related)
H00925 2-Methyl-3-hydroxybutyryl-CoA dehydrogenase (MHBD) deficiency Q99714 (related)