Showing entry for Chalcone


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0049858
Compound NameChalcone
Structure
FormulaC15H12O
InchiKeyDQFBYFPFKXHELB-VAWYXSNFSA-N
SMILESO=C(c1ccccc1)/C=C/c1ccccc1
InchiInChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+
IUPAC(E)-1,3-diphenylprop-2-en-1-one
Molecular Weight208.09
Pubchem Id637760
Chembl IdCHEMBL7976
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 29143
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 BXGT009172 Amine oxidase [flavin-containing] B reviewed MAOB - 1410 - -
reviewed BXGT008644 Amine oxidase [flavin-containing] A reviewed MAOA - - - -
reviewed BXGT004860 Perilipin-1 reviewed PLIN1 - 4194 - -
reviewed BXGT012560 Perilipin-5 reviewed PLIN5 - 4245 - -
reviewed BXGT010616 Stromal cell-derived factor 1 reviewed CXCL12 - >5.00e+5 - -
reviewed BXGT006430 Cholinesterase reviewed BCHE - 87000 - -
reviewed BXGT008480 Tumor necrosis factor receptor superfamily member 1A reviewed TNFRSF1A - 23000 - -
reviewed BXGT005612 Pancreatic alpha-amylase reviewed AMY2 48000 - - -
reviewed BXGT005520 Dihydrofolate reductase reviewed Enzyme DHFR - >100000 - -
reviewed BXGT010669 Arachidonate 5-lipoxygenase reviewed Alox5 - 12200 - -
reviewed BXGT012834 Prostaglandin G/H synthase 2 reviewed Ptgs2 - 11200 - -
reviewed BXGT008766 Prostaglandin G/H synthase 1 reviewed Ptgs1 - 22100 - -
reviewed BXGT008096 Androgen receptor reviewed Ar - 64565.42 - -
reviewed BXGT007824 Arachidonate 5-lipoxygenase reviewed Alox5 - 43000 - -
CHEMBL CHEMBL7976
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
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 25929 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 100000 nM
Q8WTS1 BXGT018985 1-acylglycerol-3-phosphate O-acyltransferase ABHD5 reviewed - ABHD5 IC50 '=' 4245 nM
Q00G26 BXGT012560 Perilipin-5 reviewed - PLIN5 IC50 '=' 4245 nM
P12527 BXGT007824 Arachidonate 5-lipoxygenase reviewed - Alox5 IC50 '=' 43000 nM
Q9HC16 BXGT020525 DNA dC->dU-editing enzyme APOBEC-3G reviewed Enzyme APOBEC3G Potency - 31622 nM
Q12791 BXGT013264 Calcium-activated potassium channel subunit alpha-1 reviewed Ion channel KCNMA1 Control '=' 82 %
Q962Y6 BXGT019597 Thioredoxin glutathione reductase unreviewed - TGR Potency '=' 28183 nM
Q194T2 BXGT013743 Non-structural protein 1 unreviewed - NS1 Potency '=' 2511 nM
P22437 BXGT008766 Prostaglandin G/H synthase 1 reviewed - Ptgs1 IC50 '=' 22100 nM
P48999 BXGT010669 Arachidonate 5-lipoxygenase reviewed - Alox5 IC50 '=' 12200 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 35481 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 17782 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 6513 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 79432 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 1 -
P46063 BXGT010501 ATP-dependent DNA helicase Q1 reviewed Enzyme RECQL Potency '=' 4466 nM
P21397 BXGT008644 Amine oxidase [flavin-containing] A reviewed - MAOA IC50 - - -
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB IC50 '=' 1410 nM
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency - 2393 nM
O60240 BXGT004860 Perilipin-1 reviewed - PLIN1 IC50 '=' 4194 nM
Q8WTS1 BXGT018985 1-acylglycerol-3-phosphate O-acyltransferase ABHD5 reviewed - ABHD5 IC50 '=' 4194 nM
P19438 BXGT008480 Tumor necrosis factor receptor superfamily member 1A reviewed - TNFRSF1A IC50 '=' 23000 nM
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB Activity '=' 0 %
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 14581 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 63095 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 0 -
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 14581 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 22387 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 22387 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 29092 nM
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 31 uM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 89125 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 14125 nM
Q05769 BXGT012834 Prostaglandin G/H synthase 2 reviewed - Ptgs2 IC50 '=' 11200 nM
P49798 BXGT010745 Regulator of G-protein signaling 4 reviewed Enzyme modulator RGS4 Potency - 70794 nM
P11021 BXGT007644 Endoplasmic reticulum chaperone BiP reviewed - HSPA5 Potency - 44668 nM
P15207 BXGT008096 Androgen receptor reviewed - Ar IC50 '=' 64565 nM
P52270 BXGT010924 Triosephosphate isomerase, glycosomal reviewed - Inhibition - - -
Q63921 BXGT016082 Prostaglandin G/H synthase 1 reviewed - Ptgs1 IC50 '=' 43000 nM
P35355 BXGT009817 Prostaglandin G/H synthase 2 reviewed - Ptgs2 IC50 '=' 43000 nM
P06276 BXGT006430 Cholinesterase reviewed - BCHE IC50 '=' 87000 nM
Q27686 BXGT013930 Pyruvate kinase reviewed - PYK Potency '=' 15848 nM
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency '=' 10000 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 19952 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 11220 nM
P00374 BXGT005520 Dihydrofolate reductase reviewed Enzyme DHFR Inhibition - - -
P10275 BXGT007552 Androgen receptor reviewed Nuclear receptor AR Ratio '=' 0 -
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 15848 nM
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB IC50 '=' 1412537 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 25929 nM
P00374 BXGT005520 Dihydrofolate reductase reviewed Enzyme DHFR IC50 - - -
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 28183 nM
Q16881 BXGT013688 Thioredoxin reductase 1, cytoplasmic reviewed Enzyme TXNRD1 Inhibition - - -
Q8IUX4 BXGT018337 DNA dC->dU-editing enzyme APOBEC-3F reviewed Enzyme APOBEC3F Potency - 6309 nM
P00374 BXGT005520 Dihydrofolate reductase reviewed Enzyme DHFR IC50 '>' 100000 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 IC50 '=' 26700 nM
P52270 BXGT010924 Triosephosphate isomerase, glycosomal reviewed - Inhibition '=' 33 %
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Activity - - -
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 16360 nM
P80457 BXGT011911 Xanthine dehydrogenase/oxidase reviewed - XDH Inhibition - - -
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 IC50 '=' 46400 nM
P00690 BXGT005612 Pancreatic alpha-amylase reviewed - AMY2 Ki '=' 48000 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Activity - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF05369 Daemonorops draco Daemonorops draco 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