Detailed information for compound 585426

Basic information

Technical information
  • TDR Targets ID: 585426
  • Name: methyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbam oylsulfamoylmethyl]benzoate
  • MW: 410.402 | Formula: C16H18N4O7S
  • H donors: 2 H acceptors: 6 LogP: 1.62 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1nc(nc(c1)OC)NC(=O)NS(=O)(=O)Cc1ccccc1C(=O)OC
  • InChi: 1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)
  • InChiKey: XMQFTWRPUQYINF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoylmethyl]benzoic acid methyl ester
  • 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoylmethyl]benzoic acid methyl ester
  • methyl bensulfuron
  • 104466-83-3
  • 83055-99-6
  • Bensulfuron methyl
  • C10937
  • methyl 2-{[({[(4,6-dimethoxypyrimidin-2-yl)amino]carbonyl}amino)sulfonyl]methyl}benzoate
  • BENSULFURON-METHYL
  • Bensulfuron methyl ester
  • Benzoic acid, 2-((((((4,6-dimethoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)methyl)-, methyl ester
  • DPX-F 5384
  • EPA Pesticide Chemical Code 128820
  • F 5384
  • Londax
  • Methyl alpha-(4,6-dimethoxypyrimidin-2-ylcarbamoylsulfamoyl)-o-toluate
  • 37897_RIEDEL
  • AIDS-179822
  • AIDS179822
  • NCGC00164284-01
  • PS1082_SUPELCO
  • Benzoic acid, 2-[[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]methyl]-, methyl ester

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Saccharomyces cerevisiae acetolactate synthase catalytic subunit Starlite/ChEMBL References
Zea mays Acetolactate synthase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni acetolactate synthase Get druggable targets OG5_126899 All targets in OG5_126899
Candida albicans Acetolactate synthase Get druggable targets OG5_126899 All targets in OG5_126899
Schistosoma japonicum ko:K01651 acetolactate synthase [EC2.2.1.6], putative Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium leprae PROBABLE ACETOLACTATE SYNTHASE (LARGE SUBUNIT) ILVB (ACETOHYDROXY-ACID SYNTHASE) Get druggable targets OG5_126899 All targets in OG5_126899
Brugia malayi Thiamine pyrophosphate enzyme, central domain containing protein Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium ulcerans acetolactate synthase 1 catalytic subunit Get druggable targets OG5_126899 All targets in OG5_126899
Loa Loa (eye worm) thiamine pyrophosphate enzyme Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium leprae Probable Acetolactate synthase IlvG (Acetohydroxy-acid synthase)(ALS) Get druggable targets OG5_126899 All targets in OG5_126899
Candida albicans Acetolactate synthase Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium ulcerans putative oxalyl-CoA decarboxylase Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium tuberculosis Probable acetolactate synthase IlvG (acetohydroxy-acid synthase)(ALS) Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium tuberculosis Acetolactate synthase (large subunit) IlvB1 (acetohydroxy-acid synthase) Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium tuberculosis Probable oxalyl-CoA decarboxylase OxcA Get druggable targets OG5_126899 All targets in OG5_126899
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_126899 All targets in OG5_126899
Schistosoma mansoni acetolactate synthase Get druggable targets OG5_126899 All targets in OG5_126899
Loa Loa (eye worm) ILVBL protein Get druggable targets OG5_126899 All targets in OG5_126899
Schistosoma japonicum ko:K01651 acetolactate synthase [EC2.2.1.6], putative Get druggable targets OG5_126899 All targets in OG5_126899
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus UPF0553 protein C9orf64 homolog Acetolactate synthase   638 aa 536 aa 25.0 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium ulcerans lipase LipD 0.0038 0.0105 0.0001
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
Toxoplasma gondii ABC1 family protein 0.0038 0.0105 0.0966
Echinococcus multilocularis survival motor neuron protein 1 0.0483 0.6316 0.6716
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Echinococcus granulosus serotonin transporter 0.006 0.0411 0.042
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Echinococcus granulosus tumor protein p63 0.0328 0.4153 0.441
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.033 0.3045
Mycobacterium leprae PROBABLE ACETOLACTATE SYNTHASE (LARGE SUBUNIT) ILVB (ACETOHYDROXY-ACID SYNTHASE) 0.0266 0.3287 1
Trypanosoma brucei glucose transporter 2A 0.0033 0.0044 0.0044
Brugia malayi hypothetical protein 0.006 0.0411 0.0411
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0024 0.0004
Loa Loa (eye worm) serotonin transporter b 0.006 0.0411 0.039
Toxoplasma gondii hypothetical protein 0.006 0.0411 0.3791
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.1084 0.2765
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Loa Loa (eye worm) jmjC domain-containing protein 0.0114 0.1165 0.1146
Plasmodium falciparum phd finger protein, putative 0.0093 0.0871 0.5054
Schistosoma mansoni inositol monophosphatase 0.0038 0.0104 0.0111
Loa Loa (eye worm) inositol-1 0.0038 0.0104 0.0082
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0105 0.016
Brugia malayi hypothetical protein 0.0035 0.0068 0.0068
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0105 0.0172
Onchocerca volvulus 0.0038 0.0105 0.0269
Loa Loa (eye worm) hypothetical protein 0.0032 0.0023 0.0001
Echinococcus multilocularis dnaJ subfamily B 0.0397 0.5116 0.5437
Plasmodium vivax amine transporter, putative 0.006 0.0411 0.2313
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.006 0.0411 0.042
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.039
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0068 0.0072
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0105 0.0111
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0093 0.0871 0.0927
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Echinococcus granulosus PHD finger protein rhinoceros 0.0093 0.0871 0.0911
Entamoeba histolytica pyruvate:ferredoxin oxidoreductase 0.0039 0.0117 1
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Brugia malayi Pre-SET motif family protein 0.0219 0.2635 0.2635
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Trypanosoma cruzi phosphonopyruvate decarboxylase, putative 0.0086 0.0776 0.0735
Loa Loa (eye worm) PHD-finger family protein 0.0093 0.0871 0.0851
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0105 0.0094
Mycobacterium leprae Probable lipase LipE 0.0038 0.0105 0.0172
Brugia malayi Latrophilin receptor protein 2 0.0065 0.0478 0.0478
Trypanosoma brucei C-8 sterol isomerase, putative 0.0746 1 1
Schistosoma mansoni acetolactate synthase 0.0227 0.2747 0.2924
Loa Loa (eye worm) hypothetical protein 0.0394 0.5083 0.5072
Mycobacterium tuberculosis Acetolactate synthase (large subunit) IlvB1 (acetohydroxy-acid synthase) 0.0114 0.1164 0.3444
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Echinococcus granulosus uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Trypanosoma brucei glucose transporter 1E 0.0033 0.0044 0.0044
Mycobacterium ulcerans acetolactate synthase 1 catalytic subunit 0.0266 0.3287 0.8605
Plasmodium falciparum transporter, putative 0.006 0.0411 0.231
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0746 1 1
Trichomonas vaginalis glutaminase, putative 0.0303 0.3803 1
Onchocerca volvulus 0.006 0.0411 0.1279
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0105 0.0487
Loa Loa (eye worm) glutaminase 2 0.0303 0.3803 0.3789
Treponema pallidum sodium- and chloride- dependent transporter 0.006 0.0411 1
Schistosoma mansoni jumonji domain containing protein 0.0241 0.2944 0.3133
Mycobacterium leprae PROBABLE BIFUNCTIONAL MENAQUINONE BIOSYNTHESIS PROTEIN MEND : 2-SUCCINYL-6-HYDROXY-2,4-CYCLOHEXADIENE-1-CARBOXYLATE SYNTHASE (SH 0.0047 0.0237 0.0579
Onchocerca volvulus 0.0038 0.0105 0.0269
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0098 0.0952 0.0952
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0303 0.3815 0.4049
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0032 0.0023 0.0024
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.158 0.1667
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0104 0.0159
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Echinococcus granulosus sodium and chloride dependent glycine 0.006 0.0411 0.042
Schistosoma mansoni acetolactate synthase 0.0227 0.2747 0.2924
Brugia malayi beta-lactamase family protein 0.0038 0.0105 0.0105
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0105 0.0172
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0241 0.2947 0.8952
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0108 0.1084 0.1137
Echinococcus multilocularis General substrate transporter 0.0093 0.0872 0.0912
Mycobacterium ulcerans hypothetical protein 0.0086 0.0776 0.1817
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.0104 0.7426
Loa Loa (eye worm) solute carrier family 6 member 4 0.006 0.0411 0.039
Mycobacterium ulcerans glutaminase 0.0303 0.3803 1
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Leishmania major C-8 sterol isomerase-like protein 0.0746 1 1
Toxoplasma gondii hypothetical protein 0.006 0.0411 0.3791
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.0478 0.0492
Loa Loa (eye worm) glutaminase 0.0303 0.3803 0.3789
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0105 0.016
Leishmania major phosphonopyruvate decarboxylase-like protein 0.0086 0.0776 0.0735
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.0104 0.0093
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Trichomonas vaginalis set domain proteins, putative 0.0249 0.3056 0.8014
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.039
Loa Loa (eye worm) hypothetical protein 0.0746 1 1
Echinococcus granulosus survival motor neuron protein 1 0.0483 0.6316 0.6716
Echinococcus multilocularis sodium and chloride dependent glycine 0.006 0.0411 0.042
Mycobacterium ulcerans putative oxalyl-CoA decarboxylase 0.0266 0.3287 0.8605
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0105 0.0061
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Schistosoma mansoni hypothetical protein 0.0093 0.0871 0.0927
Echinococcus granulosus lysine specific demethylase 5A 0.0114 0.1165 0.1224
Echinococcus multilocularis jumonji domain containing protein 0.0129 0.1378 0.1451
Loa Loa (eye worm) hypothetical protein 0.0139 0.1523 0.1505
Plasmodium vivax acyl-CoA synthetase, putative 0.0152 0.17 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0204 0.2424 0.2424
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0394 0.5083 0.5402
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0377 0.4848 0.5151
Echinococcus granulosus sodium and chloride dependent glycine 0.006 0.0411 0.042
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Onchocerca volvulus 0.0048 0.0247 0.0738
Schistosoma mansoni hypothetical protein 0.0374 0.4798 0.5107
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.0104 0.0093
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0105 0.0001
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Mycobacterium ulcerans pyruvate or indole-3-pyruvate decarboxylase Pdc 0.0152 0.17 0.4315
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0105 0.0172
Brugia malayi F/Y-rich N-terminus family protein 0.004 0.0135 0.0135
Onchocerca volvulus 0.006 0.0411 0.1279
Loa Loa (eye worm) hypothetical protein 0.0455 0.5932 0.5923
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0068 0.0054
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0303 0.3815 0.4049
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0871 0.8037
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0143 0.158 0.158
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Trypanosoma cruzi phosphonopyruvate decarboxylase, putative 0.0086 0.0776 0.0735
Echinococcus granulosus peregrin 0.0093 0.0871 0.0911
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Onchocerca volvulus 0.0249 0.3056 1
Echinococcus multilocularis tumor protein p63 0.0328 0.4153 0.441
Echinococcus multilocularis sodium and chloride dependent glycine 0.006 0.0411 0.042
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.158 0.1682
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0105 0.0172
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0038 0.0113 0.012
Loa Loa (eye worm) hypothetical protein 0.0065 0.0478 0.0457
Plasmodium falciparum hexose transporter 0.0108 0.1084 0.6323
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0105 0.0172
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Echinococcus multilocularis serotonin transporter 0.006 0.0411 0.042
Schistosoma mansoni sodium-dependent amino acid transporter 0.006 0.0411 0.0437
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Mycobacterium tuberculosis Probable acetolactate synthase IlvG (acetohydroxy-acid synthase)(ALS) 0.0266 0.3287 1
Leishmania major putative pyruvate/indole-pyruvate carboxylase, putative 0.0152 0.17 0.1663
Mycobacterium ulcerans 2-succinyl-5-enolpyruvyl-6-hydroxy-3-cyclohexene-1-carboxylate synthase 0.0047 0.0237 0.0358
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0105 0.0061
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Mycobacterium tuberculosis Probable oxidoreductase (beta subunit) 0.0039 0.0117 0.0209
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Echinococcus granulosus GPCR family 2 0.0065 0.0478 0.0492
Schistosoma mansoni microtubule-associated protein tau 0.0703 0.9396 1
Mycobacterium ulcerans acetolactate synthase large subunit IlvB 0.0152 0.17 0.4315
Loa Loa (eye worm) hypothetical protein 0.0455 0.5932 0.5923
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.158 0.1682
Schistosoma mansoni hypothetical protein 0.0108 0.1084 0.1153
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0105 0.0094
Schistosoma mansoni inositol monophosphatase 0.0038 0.0104 0.0111
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0038 0.0104 0.5
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0204 0.2424 0.2407
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0143 0.158 0.1562
Echinococcus granulosus uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Brugia malayi jmjC domain containing protein 0.0303 0.3815 0.3815
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Brugia malayi beta-lactamase 0.0038 0.0105 0.0105
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.0104 0.0159
Echinococcus multilocularis geminin 0.0374 0.4798 0.5098
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.158 0.1667
Loa Loa (eye worm) jmjC domain-containing protein 0.0191 0.2249 0.2231
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Loa Loa (eye worm) norepinephrine transporter 0.006 0.0411 0.039
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0517 0.6794 0.6794
Onchocerca volvulus Alhambra homolog 0.0093 0.0871 0.2795
Plasmodium falciparum amino acid transporter, putative 0.006 0.0411 0.231
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Loa Loa (eye worm) thiamine pyrophosphate enzyme 0.0152 0.1704 0.1685
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0219 0.2635 0.2619
Brugia malayi hypothetical protein 0.0483 0.6316 0.6316
Schistosoma mansoni hypothetical protein 0.0098 0.0952 0.1013
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.158 0.1667
Brugia malayi jmjC domain containing protein 0.0114 0.1165 0.1165
Onchocerca volvulus 0.0098 0.0952 0.3061
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.006 0.0411 0.0411
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0023 0.0006
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0871 0.8037
Loa Loa (eye worm) hypothetical protein 0.0517 0.6794 0.6787
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0105 0.0172
Trypanosoma brucei phosphonopyruvate decarboxylase-like protein, putative 0.0086 0.0776 0.0776
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Brugia malayi PHD-finger family protein 0.0032 0.0022 0.0022
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
Mycobacterium ulcerans acetolactate synthase 0.0152 0.17 0.4315
Plasmodium vivax hypothetical protein, conserved 0.0093 0.0871 0.5056
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Brugia malayi Thiamine pyrophosphate enzyme, central domain containing protein 0.0266 0.3287 0.3287
Brugia malayi beta-lactamase family protein 0.0038 0.0105 0.0105
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.0104 0.0961
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Brugia malayi Bromodomain containing protein 0.0093 0.0871 0.0871
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0105 0.0001
Schistosoma mansoni survival motor neuron protein 0.0098 0.0952 0.1013
Loa Loa (eye worm) ILVBL protein 0.0161 0.1823 0.1805
Giardia lamblia PHD finger protein 15 0.0093 0.0871 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0104 0.0159
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0105 0.0172
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Toxoplasma gondii facilitative glucose transporter GT1 0.0108 0.1084 1
Echinococcus granulosus jumonji domain containing protein 0.0129 0.1378 0.1451
Schistosoma mansoni hypothetical protein 0.0035 0.0068 0.0072
Loa Loa (eye worm) hypothetical protein 0.0093 0.0871 0.0851
Echinococcus multilocularis microtubule associated protein 2 0.0703 0.9396 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.0104
Mycobacterium ulcerans hypothetical protein 0.0038 0.0105 0.0001
Schistosoma mansoni hypothetical protein 0.0139 0.1523 0.1621
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
Loa Loa (eye worm) beta-lactamase 0.0038 0.0105 0.0083
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Loa Loa (eye worm) hypothetical protein 0.0381 0.4904 0.4893
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0394 0.5083 0.5402
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0068 0.0054
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.158 0.1667
Mycobacterium tuberculosis Probable oxalyl-CoA decarboxylase OxcA 0.0266 0.3287 1
Plasmodium vivax hypothetical protein, conserved 0.006 0.0411 0.2313
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.0478 0.0478
Echinococcus granulosus dnaJ subfamily B 0.0397 0.5116 0.5437
Brugia malayi PHD-finger family protein 0.0093 0.0871 0.0871
Mycobacterium ulcerans 2-oxoglutarate ferredoxin oxidoreductase subunit beta 0.0039 0.0117 0.0034
Echinococcus multilocularis GPCR, family 2 0.0065 0.0478 0.0492
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0023 0.0006
Mycobacterium ulcerans beta-lactamase 0.0038 0.0105 0.0001
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0105 0.0105
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.006 0.0411 0.5
Leishmania major hypothetical protein, conserved 0.0038 0.0105 0.0061
Brugia malayi Sugar transporter family protein 0.0108 0.1084 0.1084
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0105 0.0172
Onchocerca volvulus 0.0038 0.0105 0.0269
Loa Loa (eye worm) hypothetical protein 0.0048 0.0247 0.0225
Brugia malayi latrophilin 2 splice variant baaae 0.0139 0.1523 0.1523
Echinococcus multilocularis lysine specific demethylase 5A 0.0112 0.1143 0.1201
Schistosoma mansoni hypothetical protein 0.0374 0.4798 0.5107
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0377 0.4848 0.5151
Trichomonas vaginalis esterase, putative 0.0038 0.0105 0.016
Schistosoma mansoni hypothetical protein 0.0397 0.5116 0.5445
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0418 0.0445
Loa Loa (eye worm) sugar transporter 0.0108 0.1084 0.1064
Onchocerca volvulus 0.006 0.0411 0.1279
Schistosoma mansoni glutaminase 0.0303 0.3803 0.4047
Echinococcus multilocularis peregrin 0.0093 0.0871 0.0911
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.0478 0.0492
Trypanosoma brucei phosphonopyruvate decarboxylase-like protein, putative 0.0086 0.0776 0.0776
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.006 0.0411 0.042
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.0478 0.0457
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0105 0.0111
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0247 0.0263
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Onchocerca volvulus 0.006 0.0411 0.1279
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0105 0.0105
Schistosoma mansoni jumonji/arid domain-containing protein 0.0114 0.1165 0.124
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Mycobacterium leprae Probable Acetolactate synthase IlvG (Acetohydroxy-acid synthase)(ALS) 0.0266 0.3287 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Brugia malayi Inositol-1 0.0038 0.0104 0.0104
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Echinococcus granulosus microtubule associated protein 2 0.0703 0.9396 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0105 0.0083
Loa Loa (eye worm) hypothetical protein 0.0394 0.5083 0.5072
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Plasmodium falciparum acyl-CoA synthetase 0.0152 0.17 1
Echinococcus granulosus geminin 0.0374 0.4798 0.5098
Loa Loa (eye worm) hypothetical protein 0.0483 0.6316 0.6308
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0023 0.0212
Brugia malayi Pre-SET motif family protein 0.0032 0.0023 0.0023
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0032 0.0023 0.0006
Echinococcus granulosus General substrate transporter 0.0093 0.0872 0.0912
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Loa Loa (eye worm) hypothetical protein 0.0159 0.1795 0.1777
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Brugia malayi glutaminase DH11.1 0.0303 0.3803 0.3803
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.158 0.1682
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Mycobacterium ulcerans hypothetical protein 0.0266 0.3287 0.8605
Plasmodium vivax hexose transporter 0.0108 0.1084 0.6325
Echinococcus multilocularis PHD finger protein rhinoceros 0.0093 0.0871 0.0911
Schistosoma mansoni jumonji/arid domain-containing protein 0.0114 0.1165 0.124

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.2 uM Inhibition of Zea mays (maize) acetolactate synthase ChEMBL. No reference
Ki (binding) = 4.4 nM Inhibition of Saccharomyces cerevisiae acetohydroxyacid synthase by colorimetric assay ChEMBL. 23237384
MIC50 (functional) = 20.8 uM Antifungal activity against Saccharomyces cerevisiae after 72 hrs by broth microdilution assay ChEMBL. 23237384
MIC50 (functional) = 62 uM Antifungal activity against Candida albicans after 72 hrs by broth microdilution method ChEMBL. 23237384

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

2 literature references were collected for this gene.

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