PCIDB

KNApSAcK Metabolite C00023663

Metabolite

KNApSAcK Entry

id C00023663
Name Alternariol / 3,4',5-Trihydroxy-6'-methyl-dibenzo[a]pyrone
CAS RN 641-38-3
Standard InChI InChI=1S/C14H10O5/c1-6-2-7(15)5-11-12(6)9-3-8(16)4-10(17)13(9)14(18)19-11/h2-5,15-17H,1H3
Standard InChI (Main Layer) InChI=1S/C14H10O5/c1-6-2-7(15)5-11-12(6)9-3-8(16)4-10(17)13(9)14(18)19-11/h2-5,15-17H,1H3

Cluster

Phytochemical cluster No. 17
KCF-S cluster No. 54

Link

ChEMBL

By standard InChI CHEMBL519982
By standard InChI Main Layer CHEMBL519982

KEGG

By LinkDB C16838

CTD

By CAS RN C005197

Human Protein / Gene in interaction

23 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P08069 Insulin-like growth factor 1 receptor TK tyrosine-protein kinase INSR subfamily CHEMBL519982 CHEMBL962870 (1) CHEMBL965368 (1)
1 / 3
O14965 Aurora kinase A Aur CHEMBL519982 CHEMBL966176 (1)
0 / 0
P68400 Casein kinase II subunit alpha Ck2 CHEMBL519982 CHEMBL962879 (1)
0 / 0
P24941 Cyclin-dependent kinase 2 Cdc2 CHEMBL519982 CHEMBL966179 (1)
0 / 0
O00444 Serine/threonine-protein kinase PLK4 PLK serine/threonine protein kinase subfamily CHEMBL519982 CHEMBL966209 (1)
0 / 0
P00533 Epidermal growth factor receptor TK tyrosine-protein kinase EGFR subfamily CHEMBL519982 CHEMBL962866 (1)
1 / 11
P36888 Receptor-type tyrosine-protein kinase FLT3 Pdgfr CHEMBL519982 CHEMBL962874 (1) CHEMBL965370 (1)
1 / 1
P54760 Ephrin type-B receptor 4 Eph CHEMBL519982 CHEMBL962867 (1)
0 / 0
Q05397 Focal adhesion kinase 1 Fak CHEMBL519982 CHEMBL962869 (1)
0 / 0
Q02763 Angiopoietin-1 receptor Tie CHEMBL519982 CHEMBL965366 (1)
1 / 1
O60285 NUAK family SNF1-like kinase 1 CAMK serine/threonine protein kinase NUAK subfamily CHEMBL519982 CHEMBL966175 (1)
0 / 0
P06213 Insulin receptor TK tyrosine-protein kinase INSR subfamily CHEMBL519982 CHEMBL962875 (1)
5 / 4
P04626 Receptor tyrosine-protein kinase erbB-2 TK tyrosine-protein kinase EGFR subfamily CHEMBL519982 CHEMBL962868 (1)
5 / 10
P09619 Platelet-derived growth factor receptor beta Pdgfr CHEMBL519982 CHEMBL962877 (1)
5 / 1
P12931 Proto-oncogene tyrosine-protein kinase Src Src CHEMBL519982 CHEMBL962871 (1)
0 / 0
Q96GD4 Aurora kinase B Aur CHEMBL519982 CHEMBL966177 (1) CHEMBL965367 (1)
0 / 0
P35968 Vascular endothelial growth factor receptor 2 Vegfr CHEMBL519982 CHEMBL962872 (1) CHEMBL965369 (1)
1 / 0
P08581 Hepatocyte growth factor receptor TK tyrosine-protein kinase MET subfamily CHEMBL519982 CHEMBL962876 (1)
2 / 3
P35916 Vascular endothelial growth factor receptor 3 Vegfr CHEMBL519982 CHEMBL962873 (1)
2 / 1
P41279 Mitogen-activated protein kinase kinase kinase 8 Ste11 CHEMBL519982 CHEMBL966181 (1)
0 / 0
P53350 Serine/threonine-protein kinase PLK1 PLK serine/threonine protein kinase subfamily CHEMBL519982 CHEMBL962878 (1)
0 / 0
P31749 RAC-alpha serine/threonine-protein kinase Akt CHEMBL519982 CHEMBL966174 (1)
4 / 1
P11802 Cyclin-dependent kinase 4 CMGC serine/threonine protein kinase family CHEMBL519982 CHEMBL966180 (1)
1 / 3

CTD interaction (6)

compound gene gene name gene description interaction interaction type form reference
pmid
C005197 836 CASP3
CPP32
CPP32B
SCA-1
caspase 3, apoptosis-related cysteine peptidase (EC:3.4.22.56) alternariol results in increased activity of CASP3 protein increases activity
protein 22542754
C005197 842 CASP9
APAF-3
APAF3
ICE-LAP6
MCH6
PPP1R56
caspase 9, apoptosis-related cysteine peptidase (EC:3.4.22.62) alternariol results in increased activity of CASP9 protein increases activity
protein 22542754
C005197 2938 GSTA1
GST2
GSTA1-1
GTH1
glutathione S-transferase alpha 1 (EC:2.5.1.18) alternariol affects the localization of GSTA1 mRNA affects localization
mRNA 23154127
C005197 2939 GSTA2
GST2
GSTA2-2
GTA2
GTH2
glutathione S-transferase alpha 2 (EC:2.5.1.18) alternariol affects the localization of GSTA2 mRNA affects localization
mRNA 23154127
C005197 4780 NFE2L2
NRF2
nuclear factor, erythroid 2-like 2 alternariol affects the localization of NFE2L2 protein affects localization
protein 23154127
C005197 7157 TP53
BCC7
LFS1
P53
TRP53
tumor protein p53 alternariol results in increased expression of TP53 protein increases expression
protein 22542754

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (26)

OMIM preferred title UniProt
#615007 Basal ganglia calcification, idiopathic, 4; ibgc4 P09619
#114480 Breast cancer P31749
#114500 Colorectal cancer; crc P31749
#615109 Cowden syndrome 6; cws6 P31749
#610549 Diabetes mellitus, insulin-resistant, with acanthosis nigricans P06213
#125853 Diabetes mellitus, noninsulin-dependent; niddm P06213
#246200 Donohue syndrome P06213
#613659 Gastric cancer P04626
#137215 Gastric cancer, hereditary diffuse; hdgc P04626
#137800 Glioma susceptibility 1; glm1 P04626
#602089 Hemangioma, capillary infantile P35916
P35968
#114550 Hepatocellular carcinoma P08581
#609968 Hyperinsulinemic hypoglycemia, familial, 5; hhf5 P06213
#270450 Insulin-like growth factor i, resistance to P08069
#607785 Juvenile myelomonocytic leukemia; jmml P09619
#601626 Leukemia, acute myeloid; aml P09619
P36888
#211980 Lung cancer P00533
P04626
#153100 Lymphedema, hereditary, ia P35916
#609048 Melanoma, cutaneous malignant, susceptibility to, 3; cmm3 P11802
#131440 Myeloproliferative disorder, chronic, with eosinophilia P09619
#228550 Myofibromatosis, infantile, 1; imf1 P09619
#167000 Ovarian cancer P04626
#262190 Pineal hyperplasia, insulin-resistant diabetes mellitus, and somatic abnormalities P06213
#176920 Proteus syndrome P31749
#605074 Renal cell carcinoma, papillary, 1; rccp1 P08581
#600195 Venous malformations, multiple cutaneous and mucosal; vmcm Q02763

KEGG DISEASE (26)

KEGG disease name UniProt
H00016 Oral cancer P00533 (related)
P00533 (marker)
H00017 Esophageal cancer P00533 (related)
H00018 Gastric cancer P00533 (related)
P04626 (related)
P08581 (related)
H00022 Bladder cancer P00533 (related)
P04626 (related)
H00028 Choriocarcinoma P00533 (related)
P04626 (related)
H00030 Cervical cancer P00533 (related)
P04626 (related)
P11802 (related)
H00042 Glioma P00533 (related)
P00533 (marker)
P09619 (related)
P11802 (related)
H00055 Laryngeal cancer P00533 (related)
P00533 (marker)
H00019 Pancreatic cancer P04626 (related)
H00026 Endometrial Cancer P04626 (related)
H00027 Ovarian cancer P04626 (related)
H00031 Breast cancer P04626 (related)
P04626 (marker)
H00046 Cholangiocarcinoma P04626 (related)
P08581 (related)
H00719 Leprechaunism P06213 (related)
H00942 Rabson-Mendenhall syndrome P06213 (related)
H01228 Insulin-resistant diabetes mellitus with acanthosis nigricans (IRAN) P06213 (related)
H01267 Familial hyperinsulinemic hypoglycemia (HHF) P06213 (related)
H00015 Malignant pleural mesothelioma P08069 (related)
H00050 Synovial sarcoma P08069 (related)
H01274 Growth delay due to insulin-like growth factor I resistance P08069 (related)
H00021 Renal cell carcinoma P08581 (related)
H00038 Malignant melanoma P11802 (related)
H00539 PTEN hamartoma tumor syndrome (PHTS) P31749 (related)
H00535 Lymphedemas P35916 (related)
H00003 Acute myeloid leukemia (AML) P36888 (related)
H00531 Venous malformations Q02763 (related)