Showing entry for Thiram


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0041560
Compound NameThiram
Structure
FormulaC6H12N2S4
InchiKeyKUAZQDVKQLNFPE-UHFFFAOYSA-N
SMILESCN(C(=S)SSC(=S)N(C)C)C
InchiInChI=1S/C6H12N2S4/c1-7(2)5(9)11-12-6(10)8(3)4/h1-4H3
IUPACdimethylcarbamothioylsulfanyl N,N-dimethylcarbamodithioate
Molecular Weight239.99
Pubchem Id5455
Chembl IdCHEMBL120563
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 43362
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 BXGT012559 E3 ubiquitin-protein ligase Mdm2 reviewed Nucleic acid binding MDM2 - - - 180
reviewed BXGT004892 Tyrosine-protein kinase JAK2 reviewed Kinase JAK2 - 223 - -
reviewed BXGT012559 E3 ubiquitin-protein ligase Mdm2 reviewed Nucleic acid binding MDM2 - - - 80
reviewed BXGT012559 E3 ubiquitin-protein ligase Mdm2 reviewed Nucleic acid binding MDM2 - - - 400
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - 14000 - -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - 34000 - -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - 56000 - -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - - 59000 -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - - 35000 -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - 5800 - -
reviewed BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 - 7900 - -
reviewed BXGT003934 Fatty-acid amide hydrolase 1 reviewed FAAH - 44668.36 - -
reviewed BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL - 977.24 - -
CHEMBL CHEMBL120563
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
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 11220 nM
P42858 BXGT010341 Huntingtin reviewed - HTT Potency '=' 1000 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 19952 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 707 nM
P15428 BXGT008121 15-hydroxyprostaglandin dehydrogenase [NAD(+)] reviewed - HPGD Potency '=' 1000 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 28183 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 354 nM
P18054 BXGT008370 Arachidonate 12-lipoxygenase, 12S-type reviewed Enzyme ALOX12 Potency '=' 2511 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 IC50 '=' 5800 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 1000 nM
Q6W5P4 BXGT016588 Neuropeptide S receptor reviewed - NPSR1 Potency '=' 316 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 28183 nM
Q13951 BXGT013407 Core-binding factor subunit beta reviewed - CBFB Potency - 12589 nM
Q01196 BXGT012575 Runt-related transcription factor 1 reviewed Transcription factor RUNX1 Potency - 12589 nM
P37840 BXGT010015 Alpha-synuclein reviewed Transporter SNCA Potency - 5011 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 Kd '=' 35000 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 1000 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 44668 nM
P04406 BXGT006207 Glyceraldehyde-3-phosphate dehydrogenase reviewed Enzyme GAPDH Potency '=' 39810 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 79 nM
Q00987 BXGT012559 E3 ubiquitin-protein ligase Mdm2 reviewed Nucleic acid binding MDM2 EC50 '=' 180 nM
Q9Y468 BXGT022270 Lethal(3)malignant brain tumor-like protein 1 reviewed Epigenetic regulator L3MBTL1 Potency '=' 2818 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 19952 nM
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 29081 nM
P00883 BXGT005683 Fructose-bisphosphate aldolase A reviewed - ALDOA Potency '=' 63095 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 27306 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 Potency '=' 15848 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 25118 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 501 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 Activity - - -
Q6W5P4 BXGT016588 Neuropeptide S receptor reviewed - NPSR1 Potency '=' 4 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 133 nM
O60674 BXGT004892 Tyrosine-protein kinase JAK2 reviewed Kinase JAK2 IC50 '=' 223 nM
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 12589 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 1584 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 IC50 '=' 14000 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 14125 nM
O15648 BXGT004185 ATP-dependent 6-phosphofructokinase reviewed - pfk Potency - 28183 nM
O60674 BXGT004892 Tyrosine-protein kinase JAK2 reviewed Kinase JAK2 Activity '=' 13 um
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 145 nM
P9WMN3 BXGT012396 Bifunctional protein GlmU reviewed - glmU IC50 '=' 89320 nM
Q99714 BXGT019954 3-hydroxyacyl-CoA dehydrogenase type-2 reviewed Enzyme HSD17B10 Potency '=' 50 nM
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency - 9528 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 44668 nM
P15917 BXGT008169 Lethal factor reviewed - lef Potency '=' 10000 nM
P25094 BXGT009014 Peripheral myelin protein 22 reviewed - Pmp22 Potency - 1438 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 39810 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 IC50 '=' 7900 nM
P10828 BXGT007624 Thyroid hormone receptor beta reviewed Nuclear receptor THRB Potency - 39810 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 891 nM
Q03181 BXGT012701 Peroxisome proliferator-activated receptor delta reviewed Nuclear receptor PPARD Potency - 50118 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 44668 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 125 nM
Q92830 BXGT019379 Histone acetyltransferase KAT2A reviewed - KAT2A Potency - 31622 nM
P07900 BXGT006696 Heat shock protein HSP 90-alpha reviewed Chaperone HSP90AA1 AC50 '=' 7741 nM
P10828 BXGT007624 Thyroid hormone receptor beta reviewed Nuclear receptor THRB Potency - 50118 nM
P10275 BXGT007552 Androgen receptor reviewed Nuclear receptor AR Potency - 22387 nM
O15648 BXGT004185 ATP-dependent 6-phosphofructokinase reviewed - pfk Potency - 30131 nM
P14618 BXGT008027 Pyruvate kinase PKM reviewed Kinase PKM Potency '=' 14125 nM
P10275 BXGT007552 Androgen receptor reviewed Nuclear receptor AR Potency - 891 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 1122 nM
P07550 BXGT006636 Beta-2 adrenergic receptor reviewed G-protein coupled receptor ADRB2 Potency - 631 nM
P16050 BXGT008184 Arachidonate 15-lipoxygenase reviewed Enzyme ALOX15 Potency '=' 125 nM
Q96RI1 BXGT019727 Bile acid receptor reviewed Nuclear receptor NR1H4 Potency - 44668 nM
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 31622 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL Inhibition '>' 50 %
B2RXH2 BXGT002006 Lysine-specific demethylase 4E reviewed - KDM4E Potency '=' 25118 nM
Q92830 BXGT019379 Histone acetyltransferase KAT2A reviewed - KAT2A Potency - 15848 nM
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG Potency - 31622 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 2511 nM
Q16637 BXGT013646 Survival motor neuron protein reviewed Epigenetic regulator SMN1 Potency '=' 35481 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 2511 nM
O00519 BXGT003934 Fatty-acid amide hydrolase 1 reviewed - FAAH IC50 '=' 44668 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 1258 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 1333 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 9 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 130 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 2818 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 1122 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 2511 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 112 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 22387 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 22387 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 3548 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 15848 nM
P53350 BXGT010984 Serine/threonine-protein kinase PLK1 reviewed Kinase PLK1 Potency - 335 nM
P51449 BXGT010846 Nuclear receptor ROR-gamma reviewed Nuclear receptor RORC Potency - 5308 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL IC50 '=' 977 nM
P04637 BXGT006243 Cellular tumor antigen p53 reviewed Transcription factor TP53 Potency '=' 31622 nM
P58215 BXGT026106 Lysyl oxidase homolog 3 reviewed - LOXL3 Inhibition '<=' 40 %
Q9HC16 BXGT020525 DNA dC->dU-editing enzyme APOBEC-3G reviewed Enzyme APOBEC3G Potency - 1122 nM
Q9H9B1 BXGT020501 Histone-lysine N-methyltransferase EHMT1 reviewed Epigenetic regulator EHMT1 Inhibition '>' 50 %
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 5 nM
Q57TT1 BXGT015153 Uncharacterized protein unreviewed - Tb927.8.6820 Potency - 4466 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 50118 nM
P25094 BXGT009014 Peripheral myelin protein 22 reviewed - Pmp22 Potency - 22370 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 398 nM
Q8IL32 BXGT018308 Heat shock protein 90, putative unreviewed - PF3D7_1443900 AC50 '=' 3957 nM
P00811 BXGT005666 Beta-lactamase reviewed - ampC Potency '=' 79432 nM
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 104 %
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 21136 nM
Q12809 BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 Potency - 44668 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Inhibition '>' 50 %
P10145 BXGT007542 Interleukin-8 reviewed Signaling CXCL8 Potency - 74978 nM
Q9R1A7 BXGT021413 Nuclear receptor subfamily 1 group I member 2 reviewed - Nr1i2 Potency - 79432 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 3981 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 1000 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 22387 nM
O60674 BXGT004892 Tyrosine-protein kinase JAK2 reviewed Kinase JAK2 Activity '=' 2 um
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 35481 nM
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency - 4053 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 42163 nM
Q77YF9 BXGT016886 Protein Vpr unreviewed - vpr Potency - 3162 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 35481 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 IC50 '=' 56000 nM
Q57TT1 BXGT015153 Uncharacterized protein unreviewed - Tb927.8.6820 Potency - 35481 nM
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 99 %
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 IC50 '=' 34000 nM
P19838 BXGT008526 Nuclear factor NF-kappa-B p105 subunit reviewed Transcription factor NFKB1 Potency - 31622 nM
Q92830 BXGT019379 Histone acetyltransferase KAT2A reviewed - KAT2A Potency - 14125 nM
Q9Y4K0 BXGT022280 Lysyl oxidase homolog 2 reviewed - LOXL2 IC50 '=' 170 nM
O75936 BXGT005167 Gamma-butyrobetaine dioxygenase reviewed Enzyme BBOX1 Kd '=' 59000 nM
P58215 BXGT026106 Lysyl oxidase homolog 3 reviewed - LOXL3 IC50 '=' 110 nM
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 25918 nM
Q9H9B1 BXGT020501 Histone-lysine N-methyltransferase EHMT1 reviewed Epigenetic regulator EHMT1 Inhibition - - -
Q9H9B1 BXGT020501 Histone-lysine N-methyltransferase EHMT1 reviewed Epigenetic regulator EHMT1 IC50 '=' 1100 nM
P28300 BXGT009243 Protein-lysine 6-oxidase reviewed - LOX IC50 '=' 1040 nM
P28300 BXGT009243 Protein-lysine 6-oxidase reviewed - LOX Inhibition '<=' 40 %
Q9Y4K0 BXGT022280 Lysyl oxidase homolog 2 reviewed - LOXL2 Inhibition '<=' 40 %
Q96JB6 BXGT026118 Lysyl oxidase homolog 4 reviewed - LOXL4 Inhibition '<=' 40 %
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 IC50 '=' 550 nM
Q96JB6 BXGT026118 Lysyl oxidase homolog 4 reviewed - LOXL4 IC50 '=' 180 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01160 Juncus effusus Juncus effusus 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