Showing entry for 5,7-Dihydroxy-3-(4-Hydroxyphenyl)-6,8-Bis(3-Methylbut-2-Enyl)Chromen-4-One


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0026894
Compound Name5,7-Dihydroxy-3-(4-Hydroxyphenyl)-6,8-Bis(3-Methylbut-2-Enyl)Chromen-4-One
Structure
FormulaC25H26O5
InchiKeyUCHYSPNEUSDFQR-UHFFFAOYSA-N
SMILESCC(=CCc1c(O)c(CC=C(C)C)c2c(c1O)c(=O)c(co2)c1ccc(cc1)O)C
InchiInChI=1S/C25H26O5/c1-14(2)5-11-18-22(27)19(12-6-15(3)4)25-21(23(18)28)24(29)20(13-30-25)16-7-9-17(26)10-8-16/h5-10,13,26-28H,11-12H2,1-4H3
IUPAC5,7-dihydroxy-3-(4-hydroxyphenyl)-6,8-bis(3-methylbut-2-enyl)chromen-4-one
Molecular Weight406.18
Pubchem Id480783
Chembl IdCHEMBL494252
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB 50442403
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT005592 Pancreatic triacylglycerol lipase reviewed PNLIP - 65000 - -
reviewed BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed PTPN1 - 9300 - -
reviewed BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed PTPN1 9600 - - -
reviewed BXGT007573 Sialidase reviewed nanH 4290 - - -
reviewed BXGT007573 Sialidase reviewed nanH - 4040 - -
CHEMBL CHEMBL494252
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 Ki '=' 9600 nM
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency - 37933 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 18356 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 39810 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 15848 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 398 nM
P10520 BXGT007576 Streptokinase A reviewed - ska EC50 '=' 1863 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 29092 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 29092 nM
P02791 BXGT005965 Ferritin light chain reviewed - FTL Potency '=' 19952 nM
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 29081 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 31622 nM
P01215 BXGT005743 Glycoprotein hormones alpha chain reviewed - CGA Potency - 28183 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 19952 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 44668 nM
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 29092 nM
P10481 BXGT007573 Sialidase reviewed - nanH Ki '=' 4290 nM
P10481 BXGT007573 Sialidase reviewed - nanH Inhibition - - -
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 IC50 '=' 9300 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 11220 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 14125 nM
P04062 BXGT006140 Lysosomal acid glucosylceramidase reviewed - GBA Potency - 12589 nM
P00591 BXGT005592 Pancreatic triacylglycerol lipase reviewed - PNLIP Inhibition '=' 72 %
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 25929 nM
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 Inhibition '>' 95 %
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 39810 nM
P00591 BXGT005592 Pancreatic triacylglycerol lipase reviewed - PNLIP IC50 '=' 65000 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 9200 nM
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 44668 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 25118 nM
P10481 BXGT007573 Sialidase reviewed - nanH IC50 '=' 4040 nM
Q77YF9 BXGT016886 Protein Vpr unreviewed - vpr Potency - 63095 nM
P00591 BXGT005592 Pancreatic triacylglycerol lipase reviewed - PNLIP Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 1 -
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 Inhibition '=' 51 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00857 Mitracarpus scaber Mitracarpus scaber Others
BXGF02131 Glycyrrhiza Glycyrrhiza Medicinal Plant
BXGF02381 Glycyrrhiza inflata Glycyrrhiza inflata Medicinal Plant
BXGF03506 Millettia pachycarpa Millettia pachycarpa Medicinal Plant
BXGF04435 Derris scandens Derris scandens Medicinal Plant
BXGF04640 Anthotroche myoporoides Anthotroche myoporoides Others
BXGF04657 Helenium virginicum Helenium virginicum Others
BXGF04676 Hypericum caprifoliatum Hypericum caprifoliatum Others
BXGF04682 Astragalus flexus Astragalus flexus Others
BXGF04686 Nannoglottis ravida Nannoglottis ravida Medicinal Plant
BXGF04769 Heliotropium digynum Heliotropium digynum Others
BXGF04816 Erythrina vogelii Erythrina vogelii Others
BXGF04872 Glycyrrhiza glabra Glycyrrhiza glabra Medicinal Plant
BXGF04967 Cudrania tricuspidata Cudrania tricuspidata Medicinal Plant
BXGF05202 Flemingia philippinensis Flemingia philippinensis Medicinal Plant
BXGF05790 Glycyrrhiza uralensis Glycyrrhiza uralensis Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease