Metabolite

KNApSAcK Entry

id C00043449
Name Deoxypicropodophyllin
CAS RN 24150-39-8
Standard InChI InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20+/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3

Cluster

Phytochemical cluster No. 21
KCF-S cluster No. 427

Link

ChEMBL

By standard InChI CHEMBL519603
By standard InChI Main Layer CHEMBL63970 CHEMBL149525 CHEMBL152144 CHEMBL255919 CHEMBL519603 CHEMBL476679 CHEMBL1736070

KEGG

By LinkDB

CTD

By CAS RN

Human Protein / Gene in interaction

7 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein CHEMBL1736070 CHEMBL2114784 (1)
1 / 1
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL1736070 CHEMBL1794584 (1)
2 / 0
O75496 Geminin Unclassified protein CHEMBL1736070 CHEMBL2114843 (1) CHEMBL2114780 (1)
0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL1736070 CHEMBL2114788 (1)
0 / 0
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL63970 CHEMBL970804 (2) CHEMBL977201 (1)
0 / 1
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein CHEMBL1736070 CHEMBL1738184 (1)
0 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme CHEMBL1736070 CHEMBL2354311 (1)
1 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (4)

OMIM preferred title UniProt
#114500 Colorectal cancer; crc P84022
#137800 Glioma susceptibility 1; glm1 O75874
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#183090 Spinocerebellar ataxia 2; sca2 Q99700

KEGG DISEASE (2)

KEGG disease name UniProt
H00036 Osteosarcoma P08684 (marker)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)