Showing entry for Triclosan


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0026935
Compound NameTriclosan
Structure
FormulaC12H7Cl3O2
InchiKeyXEFQLINVKFYRCS-UHFFFAOYSA-N
SMILESClc1ccc(c(c1)O)Oc1ccc(cc1Cl)Cl
InchiInChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
IUPAC5-chloro-2-(2,4-dichlorophenoxy)phenol
Molecular Weight287.95
Pubchem Id5564
Chembl IdCHEMBL849
Targets of Information Source
DrugBank DB08604
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
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI approved; investigational -
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA approved; investigational -
O24990 BXGT004234 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI approved; investigational -
A0A348A0U3 BXGT022662 Enoyl-[acyl-carrier-protein] reductase [NADH] (EC 1.3.1.9) unreviewed - fabI GBAA_1232 approved; investigational -
Q6GI75 BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed - fabI approved; investigational -
O75469 BXGT005128 Nuclear receptor subfamily 1 group I member 2 reviewed Nuclear receptor NR1I2 approved; investigational -
P10275 BXGT007552 Androgen receptor reviewed Nuclear receptor AR approved; investigational -
Q14994 BXGT013519 Nuclear receptor subfamily 1 group I member 3 reviewed Nuclear receptor NR1I3 approved; investigational inverse agonist
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG approved; investigational -
P07202 BXGT006565 Thyroid peroxidase reviewed Enzyme TPO approved; investigational weak inhibitor
PDB TCL
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
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - 120 - -
P80030 BXGT011869 Enoyl-[acyl-carrier-protein] reductase [NADH], chloroplastic reviewed - - - - -
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - - -
Q9BH77 BXGT020093 Enoyl-ACP reductase unreviewed FabI - 50 - - -
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - - - - -
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - 0.022 -
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed FabI - - - - -
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - 220 - - -
Q6UCJ9 BXGT016559 Enoyl-acyl carrier reductase unreviewed ENR - - - - -
Q9BH77 BXGT020093 Enoyl-ACP reductase unreviewed FabI - 0.4 - - -
O24990 BXGT004234 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - - -
A0A348A0U3 BXGT022662 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed fabI - - 3600 - -
Q5SLI9 BXGT015804 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed TTHA0304 - - - - -
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed FabI - 28 - - -
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed FabI - 38 - - -
Q6TEI5 BXGT016538 Enoyl-acyl carrier protein reductase unreviewed FABI - - - - -
Q6GI75 BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI - - - 2.92 -
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed fabI - - - - -
P71079 BXGT011686 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabL reviewed fabL - - - - -
P54616 BXGT011059 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - - -
Q8KLP4 BXGT018432 Repressor unreviewed smeT - - - 630 -
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - 380 - -
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - 470 - -
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - 68500 - -
A0A0H3JLH9 BXGT000409 Enoyl-[acyl-carrier-protein] reductase [NADPH] unreviewed fabI - - - - -
A1KVU8 BXGT001019 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed fabI - - - - -
Q9ZFE4 BXGT022448 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - - -
P49327 BXGT010694 Fatty acid synthase reviewed FASN Enzyme - 54700 - -
A0A0H3HP34 BXGT000405 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed fabI - - - - -
Q81GI3 BXGT017325 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - - - - -
D0CAD5 BXGT023720 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed fabI - - - - -
Binding DB 8726
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 BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI - 70 - -
reviewed BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - 430 - -
reviewed BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI - 1100 - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - 1000 - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA 220 - - -
reviewed BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI 0.05 - - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - 3000 - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - 630 - -
reviewed BXGT005953 Transthyretin reviewed Transporter TTR - 53500 - -
reviewed BXGT005953 Transthyretin reviewed Transporter TTR - - 144000 -
reviewed BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI - 440 - -
reviewed BXGT008201 Carbonyl reductase [NADPH] 1 reviewed CBR1 - 400 - -
reviewed BXGT008201 Carbonyl reductase [NADPH] 1 reviewed CBR1 60 - - -
reviewed BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - 900 - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA 200 - - -
reviewed BXGT011059 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed fabI - 500 - -
reviewed BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed fabI - 59 - -
reviewed BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed inhA - 200 - -
CHEMBL CHEMBL849
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
P16152 BXGT008201 Carbonyl reductase [NADPH] 1 reviewed - CBR1 IC50 '=' 400 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA Inhibition '=' 37 %
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 54482 nM
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 430 nM
Q6GI75 BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed - fabI IC50 '=' 70 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 63095 nM
M9TGV3 BXGT003869 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - inhA Inhibition '>' 99 %
Q9ZFE4 BXGT022448 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI Inhibition - - -
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 199 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 660 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 39810 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 33498 nM
P02766 BXGT005953 Transthyretin reviewed Transporter TTR IC50 '=' 53500 nM
P16152 BXGT008201 Carbonyl reductase [NADPH] 1 reviewed - CBR1 Tm '<' 2 degrees C
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI IC50 '=' 73 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 0 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 0 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 13 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 0 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI IC50 '=' 66 nM
Q6UCJ9 BXGT016559 Enoyl-acyl carrier reductase unreviewed - ENR IC50 '<' 20 nM
Q9FBC5 BXGT020356 Enoyl-ACP reductase II unreviewed - fabK IC50 '>' 32000 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA Inhibition '>' 99 %
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Activity '=' 47 %
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 30 nM
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Inhibition '=' 62 %
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Kd '=' 144000 nM
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed - FabI IC50 '=' 0 ug.mL-1
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 35481 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Activity - - -
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 7943 nM
O75828 BXGT005154 Carbonyl reductase [NADPH] 3 reviewed - CBR3 Tm '<' 2 degrees C
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 28 nM
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed - FabI IC50 '=' 200 nM
P10828 BXGT007624 Thyroid hormone receptor beta reviewed Nuclear receptor THRB Potency - 44668 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 0 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 10 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 35481 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI IC50 '=' 70 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 50 nM
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Potency - 50118 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA IC50 '=' 3000 nM
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 900 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 71 nM
P54616 BXGT011059 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 500 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 0 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 31 nM
P16152 BXGT008201 Carbonyl reductase [NADPH] 1 reviewed - CBR1 Ki '=' 60 nM
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - fabI IC50 '=' 1300 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 8 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 8 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 23109 nM
P12104 BXGT007773 Fatty acid-binding protein, intestinal reviewed - FABP2 K1 '=' 7 pM
P04637 BXGT006243 Cellular tumor antigen p53 reviewed Transcription factor TP53 Potency - 79432 nM
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 35481 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 33498 nM
Q9BJJ9 BXGT020099 Enoyl-ACP reductase unreviewed - FabI Inhibition '=' 99 %
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 7695 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 7 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 1 nM
Q6UCJ9 BXGT016559 Enoyl-acyl carrier reductase unreviewed - ENR IC50 '=' 15 nM
Q6UCJ9 BXGT016559 Enoyl-acyl carrier reductase unreviewed - ENR Inhibition '=' 98 %
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Activity '=' 41 %
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 52 nM
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Activity '=' 66 %
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI IC50 '=' 0 ug.mL-1
P07900 BXGT006696 Heat shock protein HSP 90-alpha reviewed Chaperone HSP90AA1 AC50 '=' 7847 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 44668 nM
P02791 BXGT005965 Ferritin light chain reviewed - FTL Potency '=' 35481 nM
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 5 nM
Q6GI75 BXGT016310 Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI reviewed - fabI IC50 '=' 1100 nM
P02766 BXGT005953 Transthyretin reviewed Transporter TTR Activity '=' 75 %
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - fabI IC50 '=' 300 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 21136 nM
Q96RI1 BXGT019727 Bile acid receptor reviewed Nuclear receptor NR1H4 Potency - 44668 nM
P37840 BXGT010015 Alpha-synuclein reviewed Transporter SNCA Potency - 11220 nM
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - fabI IC50 '=' 14000 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA Ki '=' 200 nM
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - fabI IC50 '=' 50 nM
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 23109 nM
Q77YF9 BXGT016886 Protein Vpr unreviewed - vpr Potency - 56234 nM
Q9RMI3 BXGT021473 Enoyl-[acyl-carrier-protein] reductase [NADPH] unreviewed - fabI IC50 '=' 440 nM
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 1100 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA IC50 '=' 630 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29092 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 28183 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 10 nM
P35869 BXGT009877 Aryl hydrocarbon receptor reviewed Transcription factor AHR Potency - 70794 nM
Q8IL32 BXGT018308 Heat shock protein 90, putative unreviewed - PF3D7_1443900 AC50 '=' 7544 nM
Q5NGQ3 BXGT015601 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - fabI IC50 '=' 6000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 4855 nM
P16152 BXGT008201 Carbonyl reductase [NADPH] 1 reviewed - CBR1 Tm '=' 3 degrees C
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 17782 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 39810 nM
P9WGR1 BXGT012278 Enoyl-[acyl-carrier-protein] reductase [NADH] reviewed - inhA IC50 '=' 200 nM
P0AEK4 BXGT007320 Enoyl-[acyl-carrier-protein] reductase [NADH] FabI reviewed - fabI IC50 '=' 170 nM
Q9RMI3 BXGT021473 Enoyl-[acyl-carrier-protein] reductase [NADPH] unreviewed - fabI IC50 '=' 59 nM
M9TGV3 BXGT003869 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - inhA IC50 '=' 10000 nM
M9TGV3 BXGT003869 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - inhA Ki '=' 220 nM
M9TGV3 BXGT003869 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - inhA Ki '=' 200 nM
M9TGV3 BXGT003869 Enoyl-[acyl-carrier-protein] reductase [NADH] unreviewed - inhA IC50 '=' 1000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00076 Loquat Eriobotrya japonica Fruits
BXGF03426 Rhodiola crenulata Rhodiola crenulata 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