PCIDB

KNApSAcK Metabolite C00025306

Metabolite

KNApSAcK Entry

id C00025306
Name Fangchinoline / dl-Fangchinoline / 7-O-Demethyltetrandrine
CAS RN 436-77-1
Standard InChI InChI=1S/C37H40N2O6/c1-38-14-12-24-19-31(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-32-18-23(8-11-30(32)41-3)17-29-35-25(13-15-39(29)2)20-34(43-5)36(40)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29-/m0/s1
Standard InChI (Main Layer) InChI=1S/C37H40N2O6/c1-38-14-12-24-19-31(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-32-18-23(8-11-30(32)41-3)17-29-35-25(13-15-39(29)2)20-34(43-5)36(40)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 10

Link

ChEMBL

By standard InChI CHEMBL504256
By standard InChI Main Layer CHEMBL504256 CHEMBL509803 CHEMBL500614

KEGG

By LinkDB

CTD

By CAS RN

Human Protein / Gene in interaction

12 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein CHEMBL504256 CHEMBL2114784 (1)
1 / 1
P10253 Lysosomal alpha-glucosidase Hydrolase CHEMBL504256 CHEMBL1614076 (1)
1 / 1
P07550 Beta-2 adrenergic receptor Adrenergic receptor CHEMBL504256 CHEMBL1738166 (1) CHEMBL1794335 (1)
0 / 1
P08183 Multidrug resistance protein 1 drug CHEMBL504256 CHEMBL2077437 (1)
1 / 0
P23219 Prostaglandin G/H synthase 1 Oxidoreductase CHEMBL504256 CHEMBL1008496 (1)
0 / 0
P39748 Flap endonuclease 1 Enzyme CHEMBL504256 CHEMBL1794486 (1)
0 / 0
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL504256 CHEMBL1794584 (1)
2 / 0
O75496 Geminin Unclassified protein CHEMBL504256 CHEMBL2114843 (1) CHEMBL2114780 (1)
0 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL504256 CHEMBL2114788 (1)
0 / 0
O75164 Lysine-specific demethylase 4A Enzyme CHEMBL504256 CHEMBL1737991 (1)
0 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme CHEMBL504256 CHEMBL2354311 (1)
1 / 0
Q8IUX4 DNA dC->dU-editing enzyme APOBEC-3F Enzyme CHEMBL504256 CHEMBL1963966 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (6)

OMIM preferred title UniProt
#114500 Colorectal cancer; crc P84022
#137800 Glioma susceptibility 1; glm1 O75874
#232300 Glycogen storage disease ii P10253
#612244 Inflammatory bowel disease 13; ibd13 P08183
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#183090 Spinocerebellar ataxia 2; sca2 Q99700

KEGG DISEASE (3)

KEGG disease name UniProt
H00079 Asthma P07550 (related)
H00069 Glycogen storage diseases (GSD) P10253 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)