PCIDB

KCF-S cluster No. 891 (10 metabolites)

Corresponding Phytochemical cluster No. 25

Plant Species

Cumulative plant class count

class name count
rosids 13

Cumulative family count

class name count
Calophyllaceae 13

KEGG BRITE br08003 External link 512

Categories (1)

br08003 Category # of metabolite
Coumarins 1

metabolites link (1)

br08003 Category KEGG ID KNApSAcK ID
Coumarins C09147 C00002454

Metabolite list (10)

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
C00002454 External link 512 Calanolide A
CHEMBL7187
CHEMBL7121
CHEMBL268207
CHEMBL267447
CHEMBL263086
CHEMBL269063
CHEMBL282382
CHEMBL270362
CHEMBL518356
C075959
26 / 26 / 19
C00019764 External link 512 12-Acetoxycalanolide A
CHEMBL93010
C00019765 External link 512 12-Acetoxycalanolide B
CHEMBL93010
C00019806 External link 512 Calanolide B
CHEMBL7187
CHEMBL7121
CHEMBL268207
CHEMBL267447
CHEMBL263086
CHEMBL269063
CHEMBL282382
CHEMBL270362
CHEMBL518356
C075958
26 / 26 / 19
C00019807 External link 512 Calanolide C
CHEMBL7187
CHEMBL7121
CHEMBL268207
CHEMBL267447
CHEMBL263086
CHEMBL269063
CHEMBL282382
CHEMBL270362
CHEMBL518356
26 / 26 / 19
C00019946 External link 512 12-Methoxycalanolide A
CHEMBL329164
CHEMBL92528
C00019947 External link 512 12-Methoxycalanolide B
CHEMBL329164
CHEMBL92528
C00042414 External link 512 Cordatolide A
/ (+)-Cordatolide A
CHEMBL437217
CHEMBL403060
C113860
C00042415 External link 512 Cordatolide B
/ (-)-Cordatolide B
CHEMBL437217
CHEMBL403060
C00045467 External link 512 (-)-Calanolide B
CHEMBL7187
CHEMBL7121
CHEMBL268207
CHEMBL267447
CHEMBL263086
CHEMBL269063
CHEMBL282382
CHEMBL270362
CHEMBL518356
26 / 26 / 19

Human Protein / Gene in interactions

26 ChEMBL Protein in interactions

accession description class description KNApSAcK metabolite in interactions # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein C00002454 C00019806 C00019807 C00045467 1 / 1
P06746 DNA polymerase beta Enzyme C00002454 C00019806 C00019807 C00045467 0 / 0
P04062 Glucosylceramidase Enzyme C00002454 C00019806 C00019807 C00045467 6 / 4
P43166 Carbonic anhydrase 7 Lyase C00002454 C00019806 C00019807 C00045467 0 / 0
Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Enzyme C00002454 C00019806 C00019807 C00045467 0 / 0
Q8N1Q1 Carbonic anhydrase 13 Lyase C00002454 C00019806 C00019807 C00045467 0 / 0
P37840 Alpha-synuclein Unclassified protein C00002454 C00019806 C00019807 C00045467 4 / 2
P00918 Carbonic anhydrase 2 Lyase C00002454 C00019806 C00019807 C00045467 1 / 2
P00352 Retinal dehydrogenase 1 Enzyme C00002454 C00019806 C00019807 C00045467 0 / 0
P17405 Sphingomyelin phosphodiesterase Enzyme C00002454 C00019806 C00019807 C00045467 2 / 2
O43570 Carbonic anhydrase 12 Lyase C00002454 C00019806 C00019807 C00045467 1 / 2
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein C00002454 C00019806 C00019807 C00045467 2 / 0
O75496 Geminin Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 0
P00915 Carbonic anhydrase 1 Lyase C00002454 C00019806 C00019807 C00045467 0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor C00002454 C00019806 C00019807 C00045467 0 / 0
P63092 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short Other membrane protein C00002454 C00019806 C00019807 C00045467 7 / 3
P83916 Chromobox protein homolog 1 Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 0
P28482 Mitogen-activated protein kinase 1 Erk C00002454 C00019806 C00019807 C00045467 0 / 0
Q16790 Carbonic anhydrase 9 Lyase C00002454 C00019806 C00019807 C00045467 0 / 1
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 0
Q6W5P4 Neuropeptide S receptor Neuropeptide receptor C00002454 C00019806 C00019807 C00045467 1 / 0
O14727 Apoptotic protease-activating factor 1 Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 0
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme C00002454 C00019806 C00019807 C00045467 1 / 0
P01215 Glycoprotein hormones alpha chain Unclassified protein C00002454 C00019806 C00019807 C00045467 0 / 3
Q13148 TAR DNA-binding protein 43 Unclassified protein C00002454 C00019806 C00019807 C00045467 1 / 1

Related Diseases

Diseases related to proteins in ChEMBL interactions

OMIM (26)

OMIM preferred title UniProt
#219080 Acth-independent macronodular adrenal hyperplasia; aimah P63092
#612069 Amyotrophic lateral sclerosis 10, with or without frontotemporal dementia; als10 Q13148
#608584 Asthma-related traits, susceptibility to, 2 Q6W5P4
#114500 Colorectal cancer; crc P84022
#127750 Dementia, lewy body; dlb P37840
#608013 Gaucher disease, perinatal lethal P04062
#230800 Gaucher disease, type i P04062
#230900 Gaucher disease, type ii P04062
#231000 Gaucher disease, type iii P04062
#231005 Gaucher disease, type iiic P04062
#137800 Glioma susceptibility 1; glm1 O75874
#143860 Hyperchlorhidrosis, isolated O43570
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#174800 Mccune-albright syndrome; mas P63092
#257200 Niemann-pick disease, type a P17405
#607616 Niemann-pick disease, type b P17405
#166350 Osseous heteroplasia, progressive; poh P63092
#259730 Osteopetrosis, autosomal recessive 3; optb3 P00918
#168601 Parkinson disease 1, autosomal dominant; park1 P37840
#605543 Parkinson disease 4, autosomal dominant; park4 P37840
#168600 Parkinson disease, late-onset; pd P04062
P37840
#102200 Pituitary adenoma, growth hormone-secreting P63092
#103580 Pseudohypoparathyroidism, type ia; php1a P63092
#603233 Pseudohypoparathyroidism, type ib; php1b P63092
#612462 Pseudohypoparathyroidism, type ic; php1c P63092
#183090 Spinocerebellar ataxia 2; sca2 Q99700

KEGG DISEASE (19)

KEGG name UniProt
H01302 Hyperchlorhidrosis isolated (HCHLH) O43570 (related)
H00021 Renal cell carcinoma O43570 (marker)
Q16790 (marker)
H00241 Combined proximal and distal renal tubular acidosis (RTA type 3) P00918 (related)
H00436 Osteopetrosis P00918 (related)
H00081 Hashimoto's thyroiditis P01215 (marker)
H00082 Graves' disease P01215 (marker)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P01215 (marker)
H00066 Lewy body dementia (LBD) P04062 (related)
P37840 (related)
H00126 Gaucher disease P04062 (related)
H00426 Defects in the degradation of ganglioside P04062 (related)
H00810 Progressive myoclonic epilepsy (PME) P04062 (related)
H00137 Niemann-Pick disease (NPD) typeA and B P17405 (related)
H00424 Defects in the degradation of sphingomyelin P17405 (related)
H00057 Parkinson's disease (PD) P37840 (related)
H00244 Pseudohypoparathyroidism P63092 (related)
H00441 Progressive osseous heteroplasia (POH) P63092 (related)
H00501 Fibrous dysplasia, polyostotic P63092 (related)
H00058 Amyotrophic lateral sclerosis (ALS) Q13148 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)