Detailed information for compound 946931

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 355.401 | Formula: C18H26FNO5
  • H donors: 0 H acceptors: 2 LogP: 2.75 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)Cc1cc(OCC)c(cc1F)OCC(=O)N(CC)CC
  • InChi: 1S/C18H26FNO5/c1-5-20(6-2)17(21)12-25-16-11-14(19)13(9-15(16)23-7-3)10-18(22)24-8-4/h9,11H,5-8,10,12H2,1-4H3
  • InChiKey: JAEKBGSQUBGXRX-UHFFFAOYSA-N  


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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis GPCR, family 2 0.0033 0.0139 0.0139
Plasmodium falciparum dihydrolipoamide acyltransferase component E2 0.0051 0.0252 0.0304
Toxoplasma gondii 2-oxo acid dehydrogenases acyltransferase (catalytic domain) domain-containing protein 0.0051 0.0252 0.0219
Trypanosoma brucei acetyl-CoA carboxylase 0.1455 0.9279 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.023 0.0248
Echinococcus granulosus propionyl coenzyme A carboxylase beta chain 0.0197 0.1192 0.1284
Giardia lamblia Sgs1 DNA helicase, putative 0.0021 0.0062 0.0081
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Mycobacterium tuberculosis DlaT, dihydrolipoamide acyltransferase, E2 component of pyruvate dehydrogenase 0.0051 0.0252 0.0587
Toxoplasma gondii isocitrate dehydrogenase 0.0034 0.0144 0.0103
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0197 0.1192 0.2015
Echinococcus multilocularis isocitrate dehydrogenase 0.0034 0.0144 0.0144
Echinococcus granulosus histone lysine methyltransferase setb 0.006 0.0312 0.0336
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.0171 0.023
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.0722 0.0755
Entamoeba histolytica hypothetical protein 0.0107 0.0613 0.3832
Brugia malayi Inositol-1 0.0038 0.0171 0.0154
Trypanosoma brucei 2-oxoglutarate dehydrogenase E2 component, putative 0.0051 0.0252 0.0219
Echinococcus granulosus Biotin lipoyl attachment 0.0051 0.0252 0.0271
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0051 0.0252 0.0356
Echinococcus multilocularis ubiquitin specific protease 41 0.004 0.0181 0.0181
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0139 0.0139
Trypanosoma cruzi glutamine-dependent carbamoyl-phosphate synthetase, putative 0.0125 0.0729 0.12
Mycobacterium ulcerans acetyl-/propionyl-CoA carboxylase subunit beta 0.0197 0.1192 0.3322
Mycobacterium ulcerans bifunctional protein acetyl-/propionyl-coenzyme a carboxylase (alpha chain) AccA3 0.0554 0.3487 1
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.0722 0.0755
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0171 0.0131
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Plasmodium vivax SET domain protein, putative 0.006 0.0312 0.0395
Onchocerca volvulus Huntingtin homolog 0.0109 0.0627 0.1183
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0171 0.0214
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0062 0.0032
Echinococcus multilocularis mitogen activated protein kinase 14 0.0505 0.3173 0.3173
Trichomonas vaginalis set domain proteins, putative 0.0479 0.3004 0.5604
Trypanosoma cruzi acetyl-CoA carboxylase, putative 0.0197 0.1192 0.2015
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.023 0.0248
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.0389 0.0398
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.0171 0.0171
Mycobacterium tuberculosis Probable propionyl-CoA carboxylase beta chain 5 AccD5 (pccase) (propanoyl-CoA:carbon dioxide ligase) 0.0197 0.1192 0.3322
Wolbachia endosymbiont of Brugia malayi Acetyl/propionyl-CoA carboxylase, alpha subunit 0.0554 0.3487 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0063 0.033 0.0304
Brugia malayi isocitrate dehydrogenase 0.0034 0.0144 0.0124
Brugia malayi Lipoamide acyltransferase component of branched-chain alpha-keto aciddehydrogenase complex, mitochondrial precursor 0.0051 0.0252 0.0245
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0041 0.0189 0.0204
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.033 0.0356
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.023 0.0202
Loa Loa (eye worm) hypothetical protein 0.006 0.0312 0.0295
Schistosoma mansoni microtubule-associated protein tau 0.0717 0.4538 0.489
Echinococcus multilocularis survival motor neuron protein 1 0.0246 0.1505 0.1505
Toxoplasma gondii aldehyde dehydrogenase 0.0063 0.033 0.0304
Trypanosoma brucei mitogen-activated protein kinase 3, putative 0.0505 0.3173 0.3384
Brugia malayi Bloom's syndrome protein homolog 0.0021 0.0062 0.0032
Schistosoma mansoni hypothetical protein 0.0072 0.0389 0.0419
Schistosoma mansoni hypothetical protein 0.0033 0.0139 0.015
Leishmania major acetyl-CoA carboxylase, putative 0.1455 0.9279 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.033 0.0815
Trypanosoma cruzi glutamine dependent carbamoyl-phosphate synthase, putative 0.0125 0.0729 0.12
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0312 0.0336
Brugia malayi Intermediate filament tail domain containing protein 0.0085 0.0473 0.0493
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.004 0.0181 0.0165
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0063 0.033 0.0356
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.033 0.0815
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0181 0.0142
Plasmodium vivax carbamoyl phosphate synthetase, putative 0.0125 0.0729 0.1023
Loa Loa (eye worm) hypothetical protein 0.032 0.1984 0.2173
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0181 0.0232
Echinococcus multilocularis mitogen activated protein kinase 11 0.0505 0.3173 0.3173
Brugia malayi hypothetical protein 0.032 0.1984 0.2188
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0093 0.0047
Trichomonas vaginalis glucosylceramidase, putative 0.058 0.3655 0.6841
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0171 0.0131
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0125 0.0729 0.0786
Plasmodium falciparum carbamoyl phosphate synthetase 0.0125 0.0729 0.1023
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0554 0.3487 0.3758
Trypanosoma brucei glutamine hydrolysing (not ammonia-dependent) carbomoyl phosphate synthase, putative 0.0125 0.0729 0.0736
Mycobacterium tuberculosis Probable acetyl-/propionyl-coenzyme A carboxylase alpha chain (alpha subunit) AccA2: biotin carboxylase + biotin carboxyl carrie 0.0554 0.3487 1
Leishmania major propionyl-coa carboxylase beta chain, putative 0.0197 0.1192 0.1237
Mycobacterium ulcerans hypothetical protein 0.0051 0.0252 0.0587
Mycobacterium tuberculosis Biotinylated protein TB7.3 0.0051 0.0252 0.0587
Schistosoma mansoni hypothetical protein 0.0033 0.0139 0.015
Onchocerca volvulus 0.032 0.1984 0.54
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.004 0.0181 0.0181
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0093 0.0066
Echinococcus multilocularis lamin dm0 0.0085 0.0473 0.0473
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.0604 0.0639
Brugia malayi cytoplasmic intermediate filament protein 0.0046 0.0218 0.0207
Schistosoma mansoni propionyl-CoA carboxylase beta chain mitochondrial precursor 0.0197 0.1192 0.1284
Echinococcus granulosus survival motor neuron protein 1 0.0246 0.1505 0.1622
Mycobacterium ulcerans acetyl/propionyl CoA carboxylase subunit beta 0.0197 0.1192 0.3322
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0034 0.0144 0.0144
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.004 0.0181 0.0893
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0034 0.0144 0.0144
Echinococcus multilocularis neuropeptide s receptor 0.0944 0.5995 0.5995
Brugia malayi Pre-SET motif family protein 0.006 0.0312 0.0313
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0034 0.0145 0.0277
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0421 0.263 0.2898
Loa Loa (eye worm) hypothetical protein 0.0051 0.0252 0.0227
Echinococcus multilocularis acetyl coenzyme A carboxylase 1 0.1455 0.9279 0.9279
Schistosoma mansoni transcription factor LCR-F1 0.0107 0.0613 0.0661
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0312 0.0336
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Trypanosoma brucei dihydrolipoamide acetyltransferase E2 subunit, putative 0.0051 0.0252 0.0219
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0085 0.0473 0.0476
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Trypanosoma brucei dihydrolipoamide branched chain transacylase, putative 0.0051 0.0252 0.0219
Echinococcus granulosus intermediate filament protein 0.0085 0.0473 0.051
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0058 0.0298 0.0321
Schistosoma mansoni hypothetical protein 0.0368 0.2294 0.2472
Trichomonas vaginalis glucosylceramidase, putative 0.058 0.3655 0.6841
Plasmodium vivax biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.1053 0.6694 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.0604 0.0622
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0139 0.0139
Loa Loa (eye worm) CMGC/MAPK/JNK protein kinase 0.0251 0.1537 0.1671
Trypanosoma cruzi 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0197 0.1192 0.2015
Echinococcus multilocularis dihydrolipoyllysine residue acetyltransferase 0.0051 0.0252 0.0252
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.023 0.022
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0554 0.3487 0.3725
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0107 0.0613 0.0613
Schistosoma mansoni survival motor neuron protein 0.005 0.0246 0.0266
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0021 0.0062 0.0062
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.0171 0.0214
Brugia malayi hypothetical protein 0.0246 0.1505 0.165
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0554 0.3487 0.6067
Wolbachia endosymbiont of Brugia malayi branched-chain alpha-keto acid dehydrogenase subunit E2 0.0051 0.0252 0.0587
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.004 0.0181 0.0195
Loa Loa (eye worm) hypothetical protein 0.0085 0.0473 0.0476
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.005 0.005
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.023 0.023
Brugia malayi Isocitrate dehydrogenase 0.0034 0.0144 0.0124
Brugia malayi P38 map kinase family protein 2 0.0505 0.3173 0.3521
Loa Loa (eye worm) hypothetical protein 0.0072 0.0389 0.0381
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.033 0.0815
Entamoeba histolytica hypothetical protein 0.0107 0.0613 0.3832
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.005 0.0054
Echinococcus multilocularis geminin 0.0368 0.2294 0.2294
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.023 0.023
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0062 0.0013
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0034 0.0144 0.0156
Schistosoma mansoni aspartate carbamoyltransferase 0.0125 0.0729 0.0786
Schistosoma mansoni methylcrotonyl-CoA carboxylase 0.0554 0.3487 0.3758
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0181 0.0249
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0034 0.0144 0.0156
Onchocerca volvulus Glucosylceramidase homolog 0.0551 0.3465 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0252 0.0227
Toxoplasma gondii acetyl-CoA carboxylase ACC1 0.1455 0.9279 1
Echinococcus multilocularis Biotin lipoyl attachment 0.0051 0.0252 0.0252
Echinococcus multilocularis c Jun NH2 terminal kinase 0.0251 0.1537 0.1537
Entamoeba histolytica recQ family helicase, putative 0.0021 0.0062 0.0081
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0034 0.0144 0.0142
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.023 0.0248
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0255 0.1564 0.1702
Mycobacterium leprae Probable propyonyl-CoA carboxylase beta chain 4 AccD4 (Pccase) 0.0197 0.1192 0.3131
Brugia malayi Cytochrome P450 family protein 0.0044 0.0204 0.0191
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0062 0.0023
Mycobacterium ulcerans pyruvate carboxylase 0.0554 0.3487 1
Echinococcus granulosus mitogen activated protein kinase 14 0.0505 0.3173 0.342
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0505 0.3173 0.5513
Leishmania major dihydrolipoamide acetyltransferase precursorlike protein 0.0051 0.0252 0.0219
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.006 0.0312 0.0312
Brugia malayi Pre-SET motif family protein 0.0421 0.263 0.2911
Brugia malayi Carboxyl transferase domain containing protein 0.1404 0.8951 1
Brugia malayi follicle stimulating hormone receptor 0.0255 0.1564 0.1717
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0139 0.015
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0051 0.0252 0.0271
Echinococcus granulosus lamin dm0 0.0085 0.0473 0.051
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Trypanosoma cruzi dihydrolipoamide acetyltransferase, putative 0.0051 0.0252 0.0356
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0021 0.0062 0.0013
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0046 0.0218 0.0189
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0093 0.0066
Trypanosoma brucei 3-methylcrotonyl-CoA carboxylase alpha subunit, putative 0.0554 0.3487 0.3725
Mycobacterium tuberculosis Acetyl/propionyl-CoA carboxylase (beta subunit) AccD6 0.0197 0.1192 0.3322
Toxoplasma gondii dihydrolipoyllysine-residue succinyltransferase component of oxoglutarate dehydrogenase 0.0051 0.0252 0.0219
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0139 0.01
Schistosoma mansoni intermediate filament proteins 0.0085 0.0473 0.051
Echinococcus granulosus ubiquitin specific protease 41 0.004 0.0181 0.0195
Echinococcus multilocularis microtubule associated protein 2 0.0717 0.4538 0.4538
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.0062 0.0018
Mycobacterium leprae Probable biotinylated protein homolog TB7.3 0.0051 0.0252 0.0319
Schistosoma mansoni lamin 0.0085 0.0473 0.051
Giardia lamblia Acetyl-CoA carboxylase/pyruvate carboxylase fusion protein, putative 0.0248 0.1519 1
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.004 0.0181 0.0195
Schistosoma mansoni DNA helicase recq1 0.0021 0.0062 0.0066
Entamoeba histolytica hypothetical protein 0.0107 0.0613 0.3832
Plasmodium falciparum lipoamide acyltransferase component of branched-chain alpha-keto acid dehydrogenase complex 0.0051 0.0252 0.0304
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0062 0.0032
Echinococcus granulosus neuropeptide s receptor 0.0944 0.5995 0.6461
Mycobacterium leprae ACETYL/PROPIONYL-CoA CARBOXYLASE (BETA SUBUNIT) ACCD6 0.0197 0.1192 0.3131
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0063 0.033 0.0815
Brugia malayi hypothetical protein 0.0109 0.0627 0.0666
Loa Loa (eye worm) hypothetical protein 0.0033 0.0139 0.01
Plasmodium vivax lipoamide acyltransferase component of branched-chain alpha-keto acid dehydrogenase complex, putative 0.0051 0.0252 0.0304
Echinococcus multilocularis propionyl coenzyme A carboxylase alpha chain 0.0554 0.3487 0.3487
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.0604 0.0639
Loa Loa (eye worm) intermediate filament protein 0.0085 0.0473 0.0476
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.004 0.0181 0.0249
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.004 0.0181 0.0232
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Schistosoma mansoni acetyl-CoA carboxylase 0.1455 0.9279 1
Wolbachia endosymbiont of Brugia malayi carbamoyl phosphate synthase large subunit 0.0125 0.0729 0.1977
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0034 0.0144 0.0167
Mycobacterium ulcerans dihydrolipoamide acetyltransferase 0.0051 0.0252 0.0587
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0021 0.0062 0.0018
Leishmania major hypothetical protein, conserved 0.0026 0.0093 0.0047
Schistosoma mansoni pyruvate carboxylase 0.0554 0.3487 0.3758
Leishmania major carboxylase, putative 0.0554 0.3487 0.3725
Trypanosoma cruzi 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0051 0.0252 0.0356
Toxoplasma gondii acyl-CoA carboxyltransferase beta chain, putative 0.0197 0.1192 0.1237
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0139 0.0118
Chlamydia trachomatis acetyl-coenzyme A carboxylase carboxyl transferase subunit beta 0.0197 0.1192 0.3233
Loa Loa (eye worm) hypothetical protein 0.004 0.0181 0.0147
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0034 0.0144 0.0144
Mycobacterium ulcerans branched-chain alpha-keto acid dehydrogenase subunit E2 0.0051 0.0252 0.0587
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0034 0.0144 0.0103
Onchocerca volvulus 0.0085 0.0473 0.0705
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.033 0.0356
Mycobacterium leprae Probable bifunctional protein acetyl-/propionyl-coenzyme A carboxylase, alpha chain AccA3 (BccP) 0.0554 0.3487 1
Loa Loa (eye worm) hypothetical protein 0.0109 0.0627 0.0649
Brugia malayi MH2 domain containing protein 0.0124 0.0722 0.0772
Plasmodium falciparum dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex 0.0051 0.0252 0.0304
Echinococcus multilocularis bloom syndrome protein 0.0021 0.0062 0.0062
Plasmodium vivax dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, putative 0.0051 0.0252 0.0304
Loa Loa (eye worm) CMGC/MAPK/P38 protein kinase 0.0505 0.3173 0.3509
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0034 0.0144 0.0103
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0021 0.0062 0.0066
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.005 0.0018
Schistosoma mansoni dihydrolipoamide succinyltransferase component of 2-oxoglutarate dehydrogenase 0.0051 0.0252 0.0271
Trypanosoma brucei pyruvate dehydrogenase complex E3 binding protein, putative 0.0051 0.0252 0.0219
Wolbachia endosymbiont of Brugia malayi Acetyl-CoA carboxylase, carboxyltransferase component 0.0197 0.1192 0.3322
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0107 0.0613 0.0661
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.0171 0.0825
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0139 0.0118
Schistosoma mansoni DNA helicase recq5 0.0021 0.0062 0.0066
Schistosoma mansoni hypothetical protein 0.0033 0.0139 0.015
Onchocerca volvulus 0.0479 0.3004 0.8567
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0034 0.0144 0.0275
Schistosoma mansoni serine/threonine protein kinase 0.0251 0.1537 0.1657
Mycobacterium leprae Probable propionyl-CoA carboxylase beta chain 5 AccD5 (PCCASE) (PROPANOYL-COA:CARBON DIOXIDE LIGASE) 0.0197 0.1192 0.3131
Schistosoma mansoni dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase 0.0051 0.0252 0.0271
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0171 0.023
Mycobacterium ulcerans acetyl-coenzyme a carboxylase carboxyl transferase (subunit beta) AccD3 0.0197 0.1192 0.3322
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0062 0.0021
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Schistosoma mansoni lamin 0.0085 0.0473 0.051
Treponema pallidum pyruvate carboxylase subunit B 0.0051 0.0252 1
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.0171 0.0184
Trypanosoma cruzi mitogen-activated protein kinase 3, putative 0.0505 0.3173 0.5513
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain AccA1 0.0554 0.3487 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.004 0.0181 0.0249
Trypanosoma cruzi acetyl-CoA carboxylase 0.0901 0.5716 1
Loa Loa (eye worm) hypothetical protein 0.0084 0.0463 0.0464
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.004 0.0181 0.0142
Loa Loa (eye worm) hypothetical protein 0.0041 0.0189 0.0157
Echinococcus multilocularis mitogen activated protein kinase 14 0.0505 0.3173 0.3173
Mycobacterium ulcerans carbamoyl phosphate synthase large subunit 0.0125 0.0729 0.1977
Brugia malayi hypothetical protein 0.0107 0.0613 0.065
Echinococcus granulosus acetyl coenzyme A carboxylase 1 0.1455 0.9279 1
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Brugia malayi intermediate filament protein 0.0085 0.0473 0.0493
Echinococcus multilocularis neuropeptide receptor A26 0.0944 0.5995 0.5995
Trypanosoma cruzi 3-methylcrotonyl-CoA carboxylase, putative 0.0554 0.3487 0.6067
Toxoplasma gondii dihydrolipoamide acyltransferase, putative 0.0051 0.0252 0.0219
Leishmania major dihydrolipoamide branched chain transacylase, putative 0.0051 0.0252 0.0219
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.0171 0.023
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0093 0.0077
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0051 0.0252 0.0356
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0021 0.0062 0.0066
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.006 0.0312 0.0336
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.006 0.0312 0.0336
Toxoplasma gondii pyruvate carboxylase 0.0554 0.3487 0.3725
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0093 0.0066
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.023 0.0248
Echinococcus multilocularis lamin 0.0085 0.0473 0.0473
Loa Loa (eye worm) cytochrome P450 family protein 0.0044 0.0204 0.0173
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0041 0.0189 0.0189
Brugia malayi hypothetical protein 0.0026 0.0093 0.0067
Loa Loa (eye worm) hypothetical protein 0.0106 0.0604 0.0622
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0038 0.0171 0.0353
Schistosoma mansoni hypothetical protein 0.005 0.0246 0.0266
Brugia malayi Stress-activated protein kinase jnk-1 0.0251 0.1537 0.1686
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0062 0.0013
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0051 0.0252 0.0356
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Mycobacterium leprae Dihydrolipoamide succinyltransferase component of 2-oxoglutarate dehydrogenase complex SucB 0.0051 0.0252 0.0319
Echinococcus granulosus microtubule associated protein 2 0.0717 0.4538 0.489
Echinococcus granulosus dihydrolipoyllysine residue acetyltransferase 0.0051 0.0252 0.0271
Leishmania major 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0197 0.1192 0.1237
Toxoplasma gondii isocitrate dehydrogenase 0.0034 0.0144 0.0103
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0021 0.0062 0.0013
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Trichomonas vaginalis glucosylceramidase, putative 0.0551 0.3465 0.6479
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0063 0.033 0.033
Schistosoma mansoni carbamoyl-phosphate synthetase 0.0125 0.0729 0.0786
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.004 0.0181 0.0195
Echinococcus granulosus geminin 0.0368 0.2294 0.2472
Trypanosoma brucei 3-methylcrotonoyl-CoA carboxylase beta subunit, putative 0.0197 0.1192 0.1237
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0246 0.0239
Loa Loa (eye worm) hypothetical protein 0.004 0.0179 0.0145
Echinococcus granulosus c-Jun N-terminal kinases 0.0251 0.1537 0.1657
Echinococcus granulosus bloom syndrome protein 0.0021 0.0062 0.0066
Leishmania major carbamoyl-phosphate synthase, putative 0.0125 0.0729 0.0736
Trypanosoma cruzi dihydrolipoamide branched chain transacylase, putative 0.0051 0.0252 0.0356
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4 0.0197 0.1192 0.3322
Schistosoma mansoni ap endonuclease 0.002 0.005 0.0054
Loa Loa (eye worm) hypothetical protein 0.0109 0.0627 0.0649
Loa Loa (eye worm) isocitrate dehydrogenase 0.0034 0.0144 0.0106
Echinococcus multilocularis propionyl coenzyme A carboxylase beta chain 0.0197 0.1192 0.1192
Trypanosoma cruzi dihydrolipoamide acetyltransferase precursor, putative 0.0051 0.0252 0.0356
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0034 0.0144 0.0167
Onchocerca volvulus 0.006 0.0312 0.0204
Schistosoma mansoni inositol monophosphatase 0.0038 0.0171 0.0184
Schistosoma mansoni hypothetical protein 0.0107 0.0613 0.0661
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.004 0.0181 0.0893
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.006 0.0312 0.0284
Loa Loa (eye worm) hypothetical protein 0.0246 0.1505 0.1635
Loa Loa (eye worm) hypothetical protein 0.0026 0.0093 0.0049
Loa Loa (eye worm) carboxyl transferase domain-containing protein 0.1404 0.8951 1
Echinococcus granulosus lamin 0.0085 0.0473 0.051
Echinococcus multilocularis musashi 0.0085 0.0473 0.0473
Echinococcus granulosus GPCR family 2 0.0033 0.0139 0.015
Toxoplasma gondii biotin-requiring enzyme domain-containing protein 0.0051 0.0252 0.0219
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0034 0.0144 0.0103
Loa Loa (eye worm) hypothetical protein 0.004 0.0179 0.0145
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.004 0.0181 0.0195
Plasmodium falciparum biotin carboxylase subunit of acetyl CoA carboxylase, putative 0.1053 0.6694 1
Leishmania major methylcrotonoyl-coa carboxylase biotinylated subunitprotein-like protein 0.0554 0.3487 0.3725
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 5 AccD5 0.0197 0.1192 0.3322
Schistosoma mansoni hypothetical protein 0.0368 0.2294 0.2472
Mycobacterium tuberculosis Probable pyruvate carboxylase Pca (pyruvic carboxylase) 0.0554 0.3487 1
Brugia malayi dihydrolipoamide S-acetyltransferase precursor, putative 0.0051 0.0252 0.0245
Echinococcus multilocularis mitogen activated protein kinase 11 0.0505 0.3173 0.3173
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0021 0.0062 0.0013
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0021 0.0062 0.0062
Schistosoma mansoni dihydrolipoamide S-acetyltransferase 0.0051 0.0252 0.0271
Loa Loa (eye worm) hypothetical protein 0.0051 0.0252 0.0227
Mycobacterium ulcerans acetyl-/propionyl-coenzyme a carboxylase alpha chain, AccA2 0.0554 0.3487 1
Chlamydia trachomatis biotin carboxylase 0.0503 0.316 1
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0034 0.0144 0.0142
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0038 0.0171 0.0353
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.0171 0.0131
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0839 0.532 0.5928
Toxoplasma gondii carbamoylphosphate synthetase 0.0125 0.0729 0.0736
Schistosoma mansoni inositol monophosphatase 0.0038 0.0171 0.0184
Mycobacterium ulcerans propionyl-CoA carboxylase beta chain 4 AccD4_2 0.0197 0.1192 0.3322
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E2 0.0051 0.0252 0.0219
Echinococcus granulosus neuropeptide receptor A26 0.0944 0.5995 0.6461
Onchocerca volvulus Huntingtin homolog 0.0109 0.0627 0.1183
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.004 0.0181 0.0181
Onchocerca volvulus 0.0085 0.0473 0.0705
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.023 0.0248
Brugia malayi Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial precursor, puta 0.0051 0.0252 0.0245
Schistosoma mansoni hypothetical protein 0.0033 0.0139 0.015
Leishmania major 2-oxoglutarate dehydrogenase, E2 component, dihydrolipoamide succinyltransferase, putative 0.0051 0.0252 0.0219
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0034 0.0144 0.0144
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0139 0.015
Schistosoma mansoni ap endonuclease 0.002 0.005 0.0054
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0093 0.0047
Echinococcus granulosus dihydrolipoyllysine residue succinyltransferase 0.0051 0.0252 0.0271
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0839 0.532 0.5921
Mycobacterium tuberculosis Probable branched-chain keto acid dehydrogenase E2 component BkdC 0.0051 0.0252 0.0587
Trichomonas vaginalis DNA helicase recq1, putative 0.0021 0.0062 0.0023
Trichomonas vaginalis glucosylceramidase, putative 0.0839 0.532 1
Loa Loa (eye worm) inositol-1 0.0038 0.0171 0.0136
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0093 0.0077
Trypanosoma brucei unspecified product 0.0364 0.2267 0.2402
Echinococcus granulosus propionyl coenzyme A carboxylase alpha chain 0.0554 0.3487 0.3758
Loa Loa (eye worm) RecQ helicase 0.0021 0.0062 0.0013
Echinococcus granulosus mitogen activated protein kinase 11 0.0505 0.3173 0.342
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.006 0.0312 0.0312
Entamoeba histolytica hypothetical protein 0.0107 0.0613 0.3832
Echinococcus multilocularis dihydrolipoyllysine residue succinyltransferase 0.0051 0.0252 0.0252
Leishmania major mitogen-activated protein kinase 3, putative,map kinase 3, putative 0.0505 0.3173 0.3384
Toxoplasma gondii acetyl-coA carboxylase ACC2 0.1455 0.9279 1
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide acyltransferase E2 component 0.0051 0.0252 0.0587
Entamoeba histolytica acetyl-coA carboxylase, putative 0.0248 0.1519 1
Leishmania major dihydrolipoamide acetyltransferase precursor, putative 0.0051 0.0252 0.0219
Loa Loa (eye worm) hypothetical protein 0.0021 0.0062 0.0013
Trichomonas vaginalis DNA helicase recq, putative 0.0021 0.0062 0.0023

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) = 56.6 % Displacement of [3H]MK801 from NMDA receptor in Sprague-Dawley rat cerebral cortex membrane at 50 umol by liquid scintillation counting ChEMBL. 25462263
Activity (binding) = 89.2 % Displacement of [3H]EBOB from GABAA receptor in Sprague-Dawley rat frontoparietal cortex membrane at 50 umol by liquid scintillation counting ChEMBL. 25462263

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

1 literature reference was collected for this gene.

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