PCIDB

KNApSAcK Metabolite C00003103

Metabolite

KNApSAcK Entry

id C00003103
Name (+)-alpha-Bisabolol
CAS RN 23178-88-3
Standard InChI InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15+/m1/s1
Standard InChI (Main Layer) InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3

Cluster

Phytochemical cluster No. 38
KCF-S cluster No. 541

Link

ChEMBL

By standard InChI CHEMBL1096927
By standard InChI Main Layer CHEMBL519167 CHEMBL491186 CHEMBL477832 CHEMBL1096927 CHEMBL1171719 CHEMBL1561544 CHEMBL2104360

KEGG

By LinkDB C09621

CTD

By CAS RN

Human Protein / Gene in interaction

8 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P35354 Prostaglandin G/H synthase 2 Oxidoreductase CHEMBL519167 CHEMBL1014033 (1)
0 / 3
P40763 Signal transducer and activator of transcription 3 Transcription Factor CHEMBL1096927 CHEMBL2027549 (1)
1 / 2
O94782 Ubiquitin carboxyl-terminal hydrolase 1 Enzyme CHEMBL1561544 CHEMBL1794467 (1)
0 / 0
P28482 Mitogen-activated protein kinase 1 Erk CHEMBL1561544 CHEMBL1613808 (1)
0 / 0
P16050 Arachidonate 15-lipoxygenase Enzyme CHEMBL1561544 CHEMBL1614240 (1)
0 / 0
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL1561544 CHEMBL1614108 (1) CHEMBL1613886 (1)
0 / 1
O00255 Menin Unclassified protein CHEMBL1561544 CHEMBL1614257 (1)
2 / 5
Q03164 Histone-lysine N-methyltransferase 2A Enzyme CHEMBL1561544 CHEMBL1614257 (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
#147060 Hyper-ige recurrent infection syndrome, autosomal dominant P40763
#145000 Hyperparathyroidism 1; hrpt1 O00255
#131100 Multiple endocrine neoplasia, type i; men1 O00255

KEGG DISEASE (13)

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)
H00016 Oral cancer P40763 (related)
H00107 Other well-defined immunodeficiency syndromes P40763 (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)