PCIDB

KNApSAcK Metabolite C00000937

Metabolite

KNApSAcK Entry

id C00000937
Name Afzelechin
CAS RN 2545-00-8
Standard InChI InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-6,13,15-19H,7H2/t13-,15+/m0/s1
Standard InChI (Main Layer) InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-6,13,15-19H,7H2

Cluster

Phytochemical cluster No. 14
KCF-S cluster No. 52

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL159303 CHEMBL1326092

KEGG

By LinkDB C09320

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 12
Liliopsida 3
Spermatophyta 2
eudicotyledons 2
asterids 1

Family (Top 10)

family name count
Fabaceae 4
Arecaceae 2
Rhizophoraceae 2
Moraceae 2
Saxifragaceae 2
Rosaceae 1
Nothofagaceae 1
Actinidiaceae 1
Typhaceae 1
Pinaceae 1

List (20)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Acacia catechu 138017 Fabaceae rosids Viridiplantae
Actinidia chinensis 3625 Actinidiaceae asterids Viridiplantae
Artocarpus fretessi Hassk 3488 Moraceae rosids Viridiplantae
Artocarpus reticulatus Miq 3488 Moraceae rosids Viridiplantae
Bergenia ligulata 23238 Saxifragaceae eudicotyledons Viridiplantae
Cassia abbreviata 992663 Fabaceae rosids Viridiplantae
Cassia javanica 508996 Fabaceae rosids Viridiplantae
Cassipourea gummiflua 1237416 Rhizophoraceae rosids Viridiplantae
Cochlospermum gillivraei 66674 Bixaceae rosids Viridiplantae
Desmoncus polyacanthos 996938 Arecaceae Liliopsida Viridiplantae
Desmoncus polycanthus 169988 Arecaceae Liliopsida Viridiplantae
Eucalyptus calophylla 34324 Myrtaceae rosids Viridiplantae
Eysenhardtia subcoriacea Pennell 104319 Fabaceae rosids Viridiplantae
Juniperus communis 58039 Cupressaceae Spermatophyta Viridiplantae
Kandelia candel 61147 Rhizophoraceae rosids Viridiplantae
Larix sibirica 62751 Pinaceae Spermatophyta Viridiplantae
Nothofagus fusca 28941 Nothofagaceae rosids Viridiplantae
Prunus persica 3760 Rosaceae rosids Viridiplantae
Saxifraga ligulata 3798 Saxifragaceae eudicotyledons Viridiplantae
Typha capensis (Rohrb.) N. E. Br 4732 Typhaceae Liliopsida Viridiplantae

Human Protein / Gene in interaction

7 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P35354 Prostaglandin G/H synthase 2 Oxidoreductase CHEMBL159303 CHEMBL1020816 (1)
0 / 3
P23219 Prostaglandin G/H synthase 1 Oxidoreductase CHEMBL159303 CHEMBL1020815 (1) CHEMBL1008496 (1)
0 / 0
Q9UM73 ALK tyrosine kinase receptor TKL serine/threonine protein kinase STKR type 1 subfamily CHEMBL1326092 CHEMBL1781229 (1)
1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL1326092 CHEMBL1614108 (1) CHEMBL1613886 (1)
0 / 1
Q9UBT6 DNA polymerase kappa Enzyme CHEMBL1326092 CHEMBL1794536 (1)
0 / 0
O00255 Menin Unclassified protein CHEMBL1326092 CHEMBL1614257 (1) CHEMBL1614531 (1)
2 / 5
Q03164 Histone-lysine N-methyltransferase 2A Enzyme CHEMBL1326092 CHEMBL1614257 (1) CHEMBL1614531 (1)
1 / 3

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (4)

OMIM preferred title UniProt
#605130 Hairy elbows, short stature, facial dysmorphism, and developmental delay Q03164
#145000 Hyperparathyroidism 1; hrpt1 O00255
#131100 Multiple endocrine neoplasia, type i; men1 O00255
#613014 Neuroblastoma, susceptibility to, 3; nblst3 Q9UM73

KEGG DISEASE (12)

KEGG disease 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)
H00017 Esophageal cancer P35354 (related)
H00025 Penile cancer P35354 (related)
H00046 Cholangiocarcinoma P35354 (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)
H00014 Non-small cell lung cancer Q9UM73 (related)