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

Hover on a compound node to display the structore

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
Zea mays Acetolactate synthase Starlite/ChEMBL No references
Saccharomyces cerevisiae acetolactate synthase catalytic subunit Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans putative oxalyl-CoA decarboxylase Get druggable targets OG5_126899 All targets in OG5_126899
Candida albicans Acetolactate synthase 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 tuberculosis Probable oxalyl-CoA decarboxylase OxcA 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
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
Mycobacterium tuberculosis Probable acetolactate synthase IlvG (acetohydroxy-acid synthase)(ALS) 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 IlvG (Acetohydroxy-acid synthase)(ALS) Get druggable targets OG5_126899 All targets in OG5_126899
Schistosoma mansoni acetolactate synthase 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
Mycobacterium ulcerans acetolactate synthase 1 catalytic subunit 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 hypothetical protein Get druggable targets OG5_126899 All targets in OG5_126899
Candida albicans Acetolactate synthase 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
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.006 0.0411 0.042
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0038 0.0104 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0068 0.0054
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Leishmania major hypothetical protein, conserved 0.0038 0.0105 0.0061
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0105 0.016
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Brugia malayi hypothetical protein 0.0483 0.6316 0.6316
Schistosoma mansoni hypothetical protein 0.0098 0.0952 0.1013
Brugia malayi PHD-finger family protein 0.0032 0.0022 0.0022
Echinococcus granulosus PHD finger protein rhinoceros 0.0093 0.0871 0.0911
Plasmodium falciparum amino acid transporter, putative 0.006 0.0411 0.231
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Echinococcus multilocularis PHD finger protein rhinoceros 0.0093 0.0871 0.0911
Brugia malayi Bromodomain containing protein 0.0093 0.0871 0.0871
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.158 0.1682
Toxoplasma gondii ABC1 family protein 0.0038 0.0105 0.0966
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0139 0.1523 0.1505
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0105 0.0111
Mycobacterium ulcerans acetolactate synthase 0.0152 0.17 0.4315
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0023 0.0212
Trypanosoma brucei C-8 sterol isomerase, putative 0.0746 1 1
Brugia malayi jmjC domain containing protein 0.0303 0.3815 0.3815
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0105 0.0172
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Brugia malayi hypothetical protein 0.0035 0.0068 0.0068
Brugia malayi beta-lactamase family protein 0.0038 0.0105 0.0105
Mycobacterium tuberculosis Probable oxidoreductase (beta subunit) 0.0039 0.0117 0.0209
Brugia malayi Thiamine pyrophosphate enzyme, central domain containing protein 0.0266 0.3287 0.3287
Onchocerca volvulus 0.0038 0.0105 0.0269
Brugia malayi hypothetical protein 0.006 0.0411 0.0411
Brugia malayi Sugar transporter family protein 0.0108 0.1084 0.1084
Mycobacterium ulcerans pyruvate or indole-3-pyruvate decarboxylase Pdc 0.0152 0.17 0.4315
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.0478 0.0492
Onchocerca volvulus 0.0038 0.0105 0.0269
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.0104 0.0159
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0746 1 1
Echinococcus multilocularis sodium and chloride dependent glycine 0.006 0.0411 0.042
Loa Loa (eye worm) hypothetical protein 0.0746 1 1
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Onchocerca volvulus 0.0249 0.3056 1
Leishmania major putative pyruvate/indole-pyruvate carboxylase, putative 0.0152 0.17 0.1663
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Trichomonas vaginalis glutaminase, putative 0.0303 0.3803 1
Loa Loa (eye worm) glutaminase 2 0.0303 0.3803 0.3789
Toxoplasma gondii hypothetical protein 0.006 0.0411 0.3791
Trypanosoma brucei phosphonopyruvate decarboxylase-like protein, putative 0.0086 0.0776 0.0776
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.0478 0.0457
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Loa Loa (eye worm) serotonin transporter b 0.006 0.0411 0.039
Toxoplasma gondii facilitative glucose transporter GT1 0.0108 0.1084 1
Loa Loa (eye worm) beta-lactamase 0.0038 0.0105 0.0083
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.039
Brugia malayi Latrophilin receptor protein 2 0.0065 0.0478 0.0478
Brugia malayi F/Y-rich N-terminus family protein 0.004 0.0135 0.0135
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Plasmodium vivax amine transporter, putative 0.006 0.0411 0.2313
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Mycobacterium leprae PROBABLE ACETOLACTATE SYNTHASE (LARGE SUBUNIT) ILVB (ACETOHYDROXY-ACID SYNTHASE) 0.0266 0.3287 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0104 0.0159
Plasmodium falciparum hexose transporter 0.0108 0.1084 0.6323
Brugia malayi beta-lactamase 0.0038 0.0105 0.0105
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0105 0.016
Loa Loa (eye worm) glutaminase 0.0303 0.3803 0.3789
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Plasmodium vivax hypothetical protein, conserved 0.006 0.0411 0.2313
Mycobacterium ulcerans acetolactate synthase 1 catalytic subunit 0.0266 0.3287 0.8605
Giardia lamblia PHD finger protein 15 0.0093 0.0871 1
Echinococcus multilocularis tumor protein p63 0.0328 0.4153 0.441
Echinococcus multilocularis jumonji domain containing protein 0.0129 0.1378 0.1451
Echinococcus multilocularis serotonin transporter 0.006 0.0411 0.042
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0219 0.2635 0.2619
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0105 0.0172
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0105 0.0172
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0105 0.0172
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Trypanosoma brucei phosphonopyruvate decarboxylase-like protein, putative 0.0086 0.0776 0.0776
Echinococcus granulosus GPCR family 2 0.0065 0.0478 0.0492
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0105 0.0172
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Brugia malayi latrophilin 2 splice variant baaae 0.0139 0.1523 0.1523
Trypanosoma brucei glucose transporter 2A 0.0033 0.0044 0.0044
Onchocerca volvulus 0.006 0.0411 0.1279
Plasmodium falciparum transporter, putative 0.006 0.0411 0.231
Schistosoma mansoni hypothetical protein 0.0108 0.1084 0.1153
Echinococcus multilocularis GPCR, family 2 0.0065 0.0478 0.0492
Plasmodium falciparum phd finger protein, putative 0.0093 0.0871 0.5054
Schistosoma mansoni jumonji/arid domain-containing protein 0.0114 0.1165 0.124
Echinococcus multilocularis lysine specific demethylase 5A 0.0112 0.1143 0.1201
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0871 0.8037
Loa Loa (eye worm) inositol-1 0.0038 0.0104 0.0082
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0038 0.0113 0.012
Mycobacterium ulcerans hypothetical protein 0.0266 0.3287 0.8605
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0241 0.2947 0.8952
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0105 0.0061
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0303 0.3815 0.4049
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.158 0.1667
Echinococcus granulosus tumor protein p63 0.0328 0.4153 0.441
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.0104 0.7426
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0105 0.0061
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0032 0.0023 0.0024
Echinococcus granulosus dnaJ subfamily B 0.0397 0.5116 0.5437
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Mycobacterium tuberculosis Probable acetolactate synthase IlvG (acetohydroxy-acid synthase)(ALS) 0.0266 0.3287 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0032 0.0023 0.0006
Toxoplasma gondii PHD-finger domain-containing protein 0.0093 0.0871 0.8037
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.039
Schistosoma mansoni hypothetical protein 0.0035 0.0068 0.0072
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0093 0.0871 0.0927
Loa Loa (eye worm) hypothetical protein 0.0048 0.0247 0.0225
Schistosoma mansoni acetolactate synthase 0.0227 0.2747 0.2924
Echinococcus granulosus peregrin 0.0093 0.0871 0.0911
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Mycobacterium ulcerans hypothetical protein 0.0038 0.0105 0.0001
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) hypothetical protein 0.0381 0.4904 0.4893
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0105 0.0172
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Schistosoma mansoni hypothetical protein 0.0397 0.5116 0.5445
Echinococcus multilocularis General substrate transporter 0.0093 0.0872 0.0912
Loa Loa (eye worm) hypothetical protein 0.0159 0.1795 0.1777
Brugia malayi PHD-finger family protein 0.0093 0.0871 0.0871
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0104 0.0159
Trichomonas vaginalis esterase, putative 0.0038 0.0105 0.016
Mycobacterium ulcerans hypothetical protein 0.0086 0.0776 0.1817
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0023 0.0006
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.0478 0.0492
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Echinococcus granulosus uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0303 0.3815 0.4049
Echinococcus granulosus uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0105 0.0487
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0143 0.158 0.1562
Loa Loa (eye worm) solute carrier family 6 member 4 0.006 0.0411 0.039
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Loa Loa (eye worm) hypothetical protein 0.0517 0.6794 0.6787
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0377 0.4848 0.5151
Loa Loa (eye worm) hypothetical protein 0.0394 0.5083 0.5072
Trichomonas vaginalis conserved hypothetical protein 0.0108 0.1084 0.2765
Onchocerca volvulus 0.006 0.0411 0.1279
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Brugia malayi Calcitonin receptor-like protein seb-1 0.0204 0.2424 0.2424
Trichomonas vaginalis set domain proteins, putative 0.0249 0.3056 0.8014
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Brugia malayi Inositol-1 0.0038 0.0104 0.0104
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0105 0.0001
Treponema pallidum sodium- and chloride- dependent transporter 0.006 0.0411 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.158 0.1667
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0394 0.5083 0.5402
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Schistosoma mansoni inositol monophosphatase 0.0038 0.0104 0.0111
Mycobacterium tuberculosis Probable oxalyl-CoA decarboxylase OxcA 0.0266 0.3287 1
Echinococcus granulosus geminin 0.0374 0.4798 0.5098
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0105 0.0083
Echinococcus granulosus sodium and chloride dependent glycine 0.006 0.0411 0.042
Echinococcus granulosus lysine specific demethylase 5A 0.0114 0.1165 0.1224
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.0104 0.0093
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0377 0.4848 0.5151
Loa Loa (eye worm) PHD-finger family protein 0.0093 0.0871 0.0851
Schistosoma mansoni sodium-dependent amino acid transporter 0.006 0.0411 0.0437
Loa Loa (eye worm) hypothetical protein 0.0093 0.0871 0.0851
Mycobacterium leprae Probable Acetolactate synthase IlvG (Acetohydroxy-acid synthase)(ALS) 0.0266 0.3287 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0143 0.158 0.1667
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.006 0.0411 0.5
Brugia malayi Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.0411
Mycobacterium ulcerans putative oxalyl-CoA decarboxylase 0.0266 0.3287 0.8605
Loa Loa (eye worm) jmjC domain-containing protein 0.0191 0.2249 0.2231
Echinococcus granulosus microtubule associated protein 2 0.0703 0.9396 1
Onchocerca volvulus 0.006 0.0411 0.1279
Mycobacterium ulcerans beta-lactamase 0.0038 0.0105 0.0001
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.0104 0.0961
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.006 0.0411 0.0437
Trypanosoma cruzi phosphonopyruvate decarboxylase, putative 0.0086 0.0776 0.0735
Schistosoma mansoni jumonji/arid domain-containing protein 0.0114 0.1165 0.124
Echinococcus granulosus sodium and chloride dependent glycine 0.006 0.0411 0.042
Schistosoma mansoni hypothetical protein 0.0093 0.0871 0.0927
Loa Loa (eye worm) hypothetical protein 0.0455 0.5932 0.5923
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) sugar transporter 0.0108 0.1084 0.1064
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.0104
Schistosoma mansoni inositol monophosphatase 0.0038 0.0104 0.0111
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0517 0.6794 0.6794
Plasmodium vivax acyl-CoA synthetase, putative 0.0152 0.17 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0023 0.0001
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.0478 0.0478
Leishmania major C-8 sterol isomerase-like protein 0.0746 1 1
Brugia malayi jmjC domain containing protein 0.0114 0.1165 0.1165
Loa Loa (eye worm) jmjC domain-containing protein 0.0114 0.1165 0.1146
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0143 0.158 0.1682
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0143 0.158 0.1667
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0105 0.0111
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Mycobacterium leprae Probable lipase LipE 0.0038 0.0105 0.0172
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0105 0.0172
Trichomonas vaginalis pyruvate-flavodoxin oxidoreductase, putative 0.0039 0.0117 0.0193
Schistosoma mansoni microtubule-associated protein tau 0.0703 0.9396 1
Schistosoma mansoni sodium/chloride dependent transporter 0.006 0.0411 0.0437
Loa Loa (eye worm) hypothetical protein 0.0065 0.0478 0.0457
Schistosoma mansoni hypothetical protein 0.0374 0.4798 0.5107
Echinococcus multilocularis sodium and chloride dependent glycine 0.006 0.0411 0.042
Echinococcus granulosus jumonji domain containing protein 0.0129 0.1378 0.1451
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0105 0.0105
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
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 0.0483 0.6316 0.6308
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0023 0.0006
Schistosoma mansoni hypothetical protein 0.0374 0.4798 0.5107
Schistosoma mansoni acetolactate synthase 0.0227 0.2747 0.2924
Trypanosoma brucei THT1 - hexose transporter, putative 0.0033 0.0044 0.0044
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0105 0.0094
Mycobacterium ulcerans glutaminase 0.0303 0.3803 1
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Entamoeba histolytica pyruvate:ferredoxin oxidoreductase 0.0039 0.0117 1
Schistosoma mansoni survival motor neuron protein 0.0098 0.0952 0.1013
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0068 0.0072
Echinococcus granulosus serotonin transporter 0.006 0.0411 0.042
Onchocerca volvulus 0.0048 0.0247 0.0738
Brugia malayi Pre-SET motif family protein 0.0032 0.0023 0.0023
Schistosoma mansoni glucose transport protein 0.0108 0.1084 0.1153
Onchocerca volvulus 0.006 0.0411 0.1279
Echinococcus multilocularis survival motor neuron protein 1 0.0483 0.6316 0.6716
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0098 0.0952 0.0952
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Mycobacterium ulcerans 2-succinyl-5-enolpyruvyl-6-hydroxy-3-cyclohexene-1-carboxylate synthase 0.0047 0.0237 0.0358
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0108 0.1084 0.1137
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0068 0.0054
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Echinococcus multilocularis peregrin 0.0093 0.0871 0.0911
Plasmodium vivax hexose transporter 0.0108 0.1084 0.6325
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.006 0.0411 0.042
Trypanosoma brucei glucose transporter 1E 0.0033 0.0044 0.0044
Echinococcus multilocularis dnaJ subfamily B 0.0397 0.5116 0.5437
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.033 0.3045
Echinococcus multilocularis geminin 0.0374 0.4798 0.5098
Trypanosoma brucei glucose transporter, putative 0.0033 0.0044 0.0044
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0105 0.0094
Loa Loa (eye worm) hypothetical protein 0.0394 0.5083 0.5072
Plasmodium falciparum acyl-CoA synthetase 0.0152 0.17 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0108 0.1084 0.1137
Mycobacterium tuberculosis Conserved protein 0.0038 0.0105 0.0172
Schistosoma mansoni hypothetical protein 0.0065 0.0478 0.0509
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
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0105 0.016
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0394 0.5083 0.5402
Plasmodium vivax hypothetical protein, conserved 0.0032 0.0024 0.0004
Trypanosoma cruzi phosphonopyruvate decarboxylase, putative 0.0086 0.0776 0.0735
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0247 0.0263
Loa Loa (eye worm) ILVBL protein 0.0161 0.1823 0.1805
Onchocerca volvulus 0.0038 0.0105 0.0269
Brugia malayi beta-lactamase family protein 0.0038 0.0105 0.0105
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.0104 0.0093
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.006 0.0411 0.0437
Schistosoma mansoni hypothetical protein 0.0139 0.1523 0.1621
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0105 0.0105
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0023 0.0024
Mycobacterium ulcerans acetolactate synthase large subunit IlvB 0.0152 0.17 0.4315
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0105 0.0001
Loa Loa (eye worm) norepinephrine transporter 0.006 0.0411 0.039
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0104 0.006
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.006 0.0411 0.3791
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.006 0.0411 0.042
Brugia malayi Pre-SET motif family protein 0.0219 0.2635 0.2635
Loa Loa (eye worm) hypothetical protein 0.006 0.0411 0.039
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0418 0.0445
Brugia malayi glutaminase DH11.1 0.0303 0.3803 0.3803
Mycobacterium ulcerans lipase LipD 0.0038 0.0105 0.0001
Echinococcus multilocularis microtubule associated protein 2 0.0703 0.9396 1
Mycobacterium ulcerans 2-oxoglutarate ferredoxin oxidoreductase subunit beta 0.0039 0.0117 0.0034
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Schistosoma mansoni jumonji domain containing protein 0.0241 0.2944 0.3133
Loa Loa (eye worm) hypothetical protein 0.0455 0.5932 0.5923
Echinococcus granulosus survival motor neuron protein 1 0.0483 0.6316 0.6716
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Mycobacterium tuberculosis Acetolactate synthase (large subunit) IlvB1 (acetohydroxy-acid synthase) 0.0114 0.1164 0.3444
Leishmania major phosphonopyruvate decarboxylase-like protein 0.0086 0.0776 0.0735
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0143 0.158 0.158
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0105 0.0172
Toxoplasma gondii hypothetical protein 0.006 0.0411 0.3791
Plasmodium vivax hypothetical protein, conserved 0.0093 0.0871 0.5056
Loa Loa (eye worm) hypothetical protein 0.0038 0.0105 0.0083
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0394 0.5083 0.541
Loa Loa (eye worm) thiamine pyrophosphate enzyme 0.0152 0.1704 0.1685
Schistosoma mansoni glutaminase 0.0303 0.3803 0.4047
Echinococcus granulosus General substrate transporter 0.0093 0.0872 0.0912
Onchocerca volvulus Alhambra homolog 0.0093 0.0871 0.2795

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

2 literature references were collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.