Showing entry for Gossypetin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0036318
Compound NameGossypetin
Structure
FormulaC15H10O8
InchiKeyYRRAGUMVDQQZIY-UHFFFAOYSA-N
SMILESOc1cc(ccc1O)c1oc2c(O)c(O)cc(c2c(=O)c1O)O
InchiInChI=1S/C15H10O8/c16-6-2-1-5(3-7(6)17)14-13(22)12(21)10-8(18)4-9(19)11(20)15(10)23-14/h1-4,16-20,22H
IUPAC2-(3,4-dihydroxyphenyl)-3,5,7,8-tetrahydroxychromen-4-one
Molecular Weight318.04
Pubchem Id5280647
Chembl IdCHEMBL253570
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 26655
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 BXGT007685 Serine/threonine-protein kinase pim-1 reviewed Kinase PIM1 - 430 - -
reviewed BXGT019667 Aurora kinase B reviewed Kinase AURKB - 4100 - -
reviewed BXGT007685 Serine/threonine-protein kinase pim-1 reviewed Kinase PIM1 - 427 - -
reviewed BXGT007596 Microtubule-associated protein tau reviewed MAPT - <3000 - -
reviewed BXGT010985 Death-associated protein kinase 1 reviewed Kinase DAPK1 - 87000 - -
reviewed BXGT007717 Aromatase reviewed Enzyme CYP19A1 - 11000 - -
reviewed BXGT007573 Sialidase reviewed nanH - 800 - -
CHEMBL CHEMBL253570
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
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 1258 nM
P10481 BXGT007573 Sialidase reviewed - nanH IC50 '=' 800 nM
Q04206 BXGT012754 Transcription factor p65 reviewed Transcription factor RELA Inhibition - - -
P19838 BXGT008526 Nuclear factor NF-kappa-B p105 subunit reviewed Transcription factor NFKB1 Inhibition - - -
Q00653 BXGT012541 Nuclear factor NF-kappa-B p100 subunit reviewed Transcription factor NFKB2 Inhibition - - -
P06280 BXGT006433 Alpha-galactosidase A reviewed - GLA Potency '=' 28183 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 28183 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 28183 nM
P97697 BXGT012214 Inositol monophosphatase 1 reviewed - Impa1 Potency '=' 22387 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 35481 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 2818 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 3162 nM
P11309 BXGT007685 Serine/threonine-protein kinase pim-1 reviewed Kinase PIM1 #NAME? '=' 0 uM
P11511 BXGT007717 Aromatase reviewed Enzyme CYP19A1 IC50 '=' 11000 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 17782 nM
P16050 BXGT008184 Arachidonate 15-lipoxygenase reviewed Enzyme ALOX15 Potency '=' 3981 nM
Q86831 BXGT017584 Polyprotein II unreviewed - Inhibition '=' 85 %
Q15118 BXGT013540 [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial reviewed Kinase PDK1 Inhibition '=' 36 %
Q04206 BXGT012754 Transcription factor p65 reviewed Transcription factor RELA Activity - - -
P19838 BXGT008526 Nuclear factor NF-kappa-B p105 subunit reviewed Transcription factor NFKB1 Activity - - -
Q00653 BXGT012541 Nuclear factor NF-kappa-B p100 subunit reviewed Transcription factor NFKB2 Activity - - -
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 1122 nM
B4URF0 BXGT002146 Neuraminidase unreviewed - NA Ki '=' 7700 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency '=' 501 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 3548 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 7943 nM
B4URF0 BXGT002146 Neuraminidase unreviewed - NA IC50 '=' 2600 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 25118 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 7062 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT IC50 '<' 3000 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 79432 nM
P05067 BXGT006306 Amyloid-beta precursor protein reviewed Enzyme modulator APP IC50 '<' 3000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 18356 nM
Q15118 BXGT013540 [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial reviewed Kinase PDK1 Inhibition - - -
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29092 nM
P53355 BXGT010985 Death-associated protein kinase 1 reviewed Kinase DAPK1 IC50 '=' 87000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01806 Rhododendron mucronatum Rhododendron mucronatum Medicinal Plant
BXGF02220 Rhodiola rosea Rhodiola rosea Medicinal Plant
BXGF02251 Pyrrosia lingua Pyrrosia lingua Medicinal Plant
BXGF02543 Rhododendron mucronulatum Rhododendron mucronulatum Medicinal Plant
BXGF02978 Tetradium ruticarpum Tetradium ruticarpum Medicinal Plant
BXGF03189 Rhododendron dauricum Rhododendron dauricum Medicinal Plant
BXGF04308 Rhododendron micranthum Rhododendron micranthum Medicinal Plant
BXGF04595 Abelmoschus manihot Abelmoschus manihot Medicinal Plant
BXGF05640 Phedimus kamtschaticus Phedimus kamtschaticus 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