Showing entry for Morusin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0008181
Compound NameMorusin
Structure
FormulaC25H24O6
InchiKeyXFFOMNJIDRDDLQ-UHFFFAOYSA-N
SMILESCC(C)=CCC1=C(OC2=C(C(O)=CC3=C2C=CC(C)(C)O3)C1=O)C1=C(O)C=C(O)C=C1
InchiInChI=1S/C25H24O6/c1-13(2)5-7-17-22(29)21-19(28)12-20-16(9-10-25(3,4)31-20)24(21)30-23(17)15-8-6-14(26)11-18(15)27/h5-6,8-12,26-28H,7H2,1-4H3
IUPAC2-(2,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-3-(3-methylbut-2-en-1-yl)-4H,8H-pyrano[2,3-h]chromen-4-one
Molecular Weight420.45
Pubchem Id5281671
Chembl IdCHEMBL464006
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 50242014
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 BXGT007576 Streptokinase A reviewed ska - - - 1149
reviewed BXGT021373 Protein LANA1 reviewed LANA1 - - - >75000
reviewed BXGT004563 Polyphenol oxidase 2 reviewed PPO2 - >2.503e+5 - -
reviewed BXGT004563 Polyphenol oxidase 2 reviewed PPO2 - >3.00e+5 - -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 - 59400 - -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 64100 - - -
reviewed BXGT009816 Prostaglandin G/H synthase 2 reviewed Enzyme PTGS2 - 100000 - -
reviewed BXGT006400 Prostaglandin G/H synthase 1 reviewed PTGS1 - 100000 - -
reviewed BXGT006941 Arachidonate 5-lipoxygenase reviewed Enzyme ALOX5 - 100000 - -
reviewed BXGT008370 Arachidonate 12-lipoxygenase, 12S-type reviewed Enzyme ALOX12 - 100000 - -
reviewed BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 - 100000 - -
CHEMBL CHEMBL464006
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
P05979 BXGT006400 Prostaglandin G/H synthase 1 reviewed - PTGS1 IC50 '=' 100000 nM
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 Ki '=' 64100 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 6309 nM
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 22387 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 31622 nM
P23219 BXGT008837 Prostaglandin G/H synthase 1 reviewed Enzyme PTGS1 IC50 '=' 100000 nM
P10520 BXGT007576 Streptokinase A reviewed - ska EC50 '=' 1149 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 44668 nM
P35354 BXGT009816 Prostaglandin G/H synthase 2 reviewed Enzyme PTGS2 IC50 '=' 100000 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 35481 nM
P00533 BXGT005575 Epidermal growth factor receptor reviewed Kinase EGFR Inhibition - - -
P37840 BXGT010015 Alpha-synuclein reviewed Transporter SNCA Potency - 17782 nM
P10520 BXGT007576 Streptokinase A reviewed - ska EC50 '=' 1234 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 22387 nM
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE Ki '=' 3100 nM
P18054 BXGT008370 Arachidonate 12-lipoxygenase, 12S-type reviewed Enzyme ALOX12 IC50 '=' 100000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 20596 nM
P63092 BXGT011495 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short reviewed - GNAS Potency - 8912 nM
O97467 BXGT005437 Hexose transporter 1 unreviewed - ht1 Inhibition '=' 4 %
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 79432 nM
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 29092 nM
P09917 BXGT006941 Arachidonate 5-lipoxygenase reviewed Enzyme ALOX5 IC50 '=' 100000 nM
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 IC50 '=' 59400 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 26679 nM
O61059 BXGT004913 Glucose transporter unreviewed - LmGT2 Inhibition '=' 6 %
P06276 BXGT006430 Cholinesterase reviewed - BCHE IC50 '=' 1700 nM
O95398 BXGT005378 Rap guanine nucleotide exchange factor 3 reviewed Enzyme modulator RAPGEF3 Potency - 56234 nM
P40763 BXGT010202 Signal transducer and activator of transcription 3 reviewed Nucleic acid binding STAT3 Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 18356 nM
P11166 BXGT007661 Solute carrier family 2, facilitated glucose transporter member 1 reviewed Transporter SLC2A1 Inhibition '=' 5 %
Q05209 BXGT026141 Tyrosine-protein phosphatase non-receptor type 12 reviewed - PTPN12 IC50 '>' 100000 nM
A0A045ISB3 BXGT026108 Phosphotyrosine protein phosphatase unreviewed - ptbB IC50 '=' 5248 nM
P9WIA1 BXGT012314 Probable low molecular weight protein-tyrosine-phosphatase reviewed - ptpA IC50 '=' 4650 nM
Q08499 BXGT012988 cAMP-specific 3',5'-cyclic phosphodiesterase 4D reviewed - PDE4D IC50 '=' 900 nM
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 IC50 '=' 10320 nM
A0A045ISB3 BXGT026108 Phosphotyrosine protein phosphatase unreviewed - ptbB IC50 '=' 5260 nM
Q9Y2R2 BXGT022243 Tyrosine-protein phosphatase non-receptor type 22 reviewed - PTPN22 IC50 '=' 14970 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00823 Fruits Fruits
BXGF00947 Artocarpus dadah Artocarpus dadah Medicinal Plant
BXGF01238 Morus australis Morus australis Medicinal Plant
BXGF01426 Cornus officinalis Cornus officinalis Medicinal Plant
BXGF01905 Lonicera tatarica var. morrowii Lonicera tatarica var. morrowii Others
BXGF02131 Glycyrrhiza Glycyrrhiza Medicinal Plant
BXGF04607 Morus alba Morus alba Medicinal Plant
BXGF05476 Broussonetia papyrifera Broussonetia papyrifera Medicinal Plant
BXGF06007 Canthium berberidifolium Canthium berberidifolium Medicinal Plant
BXGF06148 Patrinia villosa Patrinia villosa Medicinal Plant
BXGF06217 Morus mongolica Morus mongolica 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