Detailed information for compound 1068333

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 326.39 | Formula: C19H22N2O3
  • H donors: 0 H acceptors: 2 LogP: 3.9 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][N+](=O)c1cccc(c1)COc1cccc(c1)CN1CCCCC1
  • InChi: 1S/C19H22N2O3/c22-21(23)18-8-4-7-17(12-18)15-24-19-9-5-6-16(13-19)14-20-10-2-1-3-11-20/h4-9,12-13H,1-3,10-11,14-15H2
  • InChiKey: QIMPSTNHQJHGRX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

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
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0027 0.0138 0.0576
Echinococcus granulosus tar DNA binding protein 0.0092 0.0823 0.0982
Schistosoma mansoni tar DNA-binding protein 0.0092 0.0823 0.1548
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Schistosoma mansoni Smad4 0.0016 0.0015 0.0029
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0271 0.0266
Schistosoma mansoni coup transcription factor 0.0021 0.0071 0.0134
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0039 0.0256 0.0127
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0094 0.0843 0.0841
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.0071 0.0134
Mycobacterium ulcerans hypothetical protein 0.0116 0.1085 0.1113
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0039 0.0256 0.1061
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0021 0.0071 0.0357
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0256 0.2101
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0138 0.1315 0.1571
Onchocerca volvulus 0.0027 0.0133 0.0751
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.0071 0.0134
Plasmodium vivax hypothetical protein, conserved 0.004 0.0271 0.1123
Schistosoma mansoni smad 0.0036 0.0225 0.0423
Onchocerca volvulus 0.0027 0.0133 0.0751
Echinococcus multilocularis smad 0.0036 0.0225 0.0223
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.024 0.2401 1
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0271 0.0266
Onchocerca volvulus 0.01 0.0914 0.5738
Trichomonas vaginalis esterase, putative 0.004 0.0271 0.0266
Leishmania major dihydroorotate dehydrogenase 0.024 0.2401 1
Onchocerca volvulus 0.0163 0.1582 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.024 0.2401 0.2516
Loa Loa (eye worm) Smad1 0.0036 0.0225 0.0267
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0138 0.1315 0.1313
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0094 0.0843 0.1006
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0173 0.1694 0.2024
Brugia malayi MH1 domain containing protein 0.0036 0.0225 0.0267
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0138 0.1315 0.1571
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0126 0.1187 0.1185
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0094 0.0843 0.0841
Echinococcus multilocularis L aminoadipate semialdehyde 0.0098 0.0887 0.0885
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0023 0.0093 0.0108
Schistosoma mansoni transcription factor LCR-F1 0.0051 0.0391 0.0736
Trichomonas vaginalis bromodomain-containing protein, putative 0.0045 0.0329 0.1249
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.0071 0.0134
Brugia malayi MH2 domain containing protein 0.0036 0.0225 0.0267
Mycobacterium tuberculosis Conserved protein 0.004 0.0271 0.0261
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0271 0.0261
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0271 0.051
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0035 0.0138
Onchocerca volvulus 0.004 0.0271 0.1634
Echinococcus granulosus lamin dm0 0.0027 0.0133 0.0157
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0061 0.0496 0.2058
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0068 0.0573 0.5408
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Schistosoma mansoni smad1 5 8 and 0.0036 0.0225 0.0423
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0271 0.051
Echinococcus multilocularis tumor protein p63 0.0232 0.2324 0.2323
Brugia malayi nuclear hormone receptor 0.0021 0.0071 0.0083
Schistosoma mansoni tar DNA-binding protein 0.0092 0.0823 0.1548
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0138 0.1315 0.1571
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0094 0.0843 1
Loa Loa (eye worm) acetyltransferase 0.0154 0.149 0.178
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.024 0.2401 1
Echinococcus granulosus microtubule associated protein 2 0.0513 0.5317 0.6359
Mycobacterium leprae conserved hypothetical protein 0.0027 0.0138 0.0042
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0023 0.0093 0.0091
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.0902 0.9468 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.0071 0.0083
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0271 0.0322
Treponema pallidum licC protein (licC) 0.0116 0.1085 1
Mycobacterium leprae Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.0902 0.9468 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0102 0.0937 0.1762
Echinococcus multilocularis mothers against decapentaplegic 6 0.0016 0.0015 0.0013
Echinococcus granulosus histone acetyltransferase KAT2B 0.0045 0.0329 0.0391
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0271 0.0322
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0039 0.0256 0.0255
Echinococcus granulosus mothers against decapentaplegic 5 0.0036 0.0225 0.0267
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0039 0.0256 0.1061
Brugia malayi hypothetical protein 0.0051 0.0391 0.0466
Echinococcus multilocularis lysine specific demethylase 5A 0.0055 0.0432 0.043
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.0071 0.0083
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0055 0.0432 0.043
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0061 0.0496 0.0494
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0035 0.0011
Onchocerca volvulus 0.0034 0.0208 0.1233
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.0071 0.0083
Schistosoma mansoni jumonji/arid domain-containing protein 0.0055 0.0432 0.0813
Brugia malayi MH2 domain containing protein 0.0036 0.0225 0.0267
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.0071 0.0069
Brugia malayi Muscleblind-like protein 0.0509 0.5274 0.6308
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0055 0.0432 0.0515
Echinococcus granulosus lysine specific demethylase 5A 0.0055 0.0432 0.0515
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0271 0.0261
Loa Loa (eye worm) hypothetical protein 0.0018 0.0035 0.004
Brugia malayi Melibiase family protein 0.0068 0.0573 0.0684
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0271 0.0269
Onchocerca volvulus Bile acid receptor homolog 0.0021 0.0071 0.0357
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.024 0.2401 0.2508
Brugia malayi intermediate filament protein 0.0027 0.0133 0.0157
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Toxoplasma gondii ABC1 family protein 0.004 0.0271 0.113
Mycobacterium tuberculosis Conserved hypothetical protein 0.0116 0.1085 0.1123
Brugia malayi mothers against decapentaplegic homolog 3 0.0016 0.0015 0.0016
Brugia malayi acetyltransferase, GNAT family protein 0.0154 0.149 0.178
Mycobacterium tuberculosis Conserved protein 0.004 0.0271 0.0261
Toxoplasma gondii eukaryotic initiation factor-2B, gamma subunit, putative 0.0116 0.1085 0.4519
Schistosoma mansoni hypothetical protein 0.0502 0.52 0.9779
Loa Loa (eye worm) hypothetical protein 0.0027 0.0133 0.0157
Entamoeba histolytica hypothetical protein 0.0051 0.0391 0.3922
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0102 0.0937 0.1762
Schistosoma mansoni microtubule-associated protein tau 0.0513 0.5317 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0042 0.0289 0.2546
Trypanosoma brucei glucosidase, putative 0.0038 0.0256 0.1057
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0172 0.1682 0.201
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.0071 0.0083
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0133 0.0157
Schistosoma mansoni hypothetical protein 0.0126 0.1187 0.2232
Mycobacterium ulcerans beta-lactamase 0.004 0.0271 0.025
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0015 0.0002 0.0004
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0094 0.0843 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0061 0.0496 0.059
Schistosoma mansoni smad1 5 8 and 0.0036 0.0225 0.0423
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0027 0.0138 0.0109
Brugia malayi exodeoxyribonuclease III family protein 0.0039 0.0256 0.0304
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1315 0.2474
Schistosoma mansoni ap endonuclease 0.0039 0.0256 0.0482
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0094 0.0843 0.1006
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0099 0.0406
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.0071 0.0083
Giardia lamblia Histone acetyltransferase GCN5 0.0042 0.0289 1
Brugia malayi beta-lactamase family protein 0.004 0.0271 0.0322
Plasmodium vivax ataxin-2 like protein, putative 0.0052 0.0396 0.1644
Loa Loa (eye worm) hypothetical protein 0.0509 0.5274 0.6308
Loa Loa (eye worm) hypothetical protein 0.0068 0.0573 0.0684
Schistosoma mansoni thyroid hormone receptor 0.0147 0.1413 0.2657
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0071 0.0083
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0027 0.0138 0.0569
Trypanosoma brucei PAB1-binding protein , putative 0.0052 0.0396 0.1644
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.0256 0.0303
Schistosoma mansoni tar DNA-binding protein 0.0092 0.0823 0.1548
Mycobacterium ulcerans hypothetical protein 0.004 0.0271 0.025
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0094 0.0843 1
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0102 0.0937 0.1119
Schistosoma mansoni protein phosphatase 2C 0.0015 0.0002 0.0004
Brugia malayi follicle stimulating hormone receptor 0.0172 0.1682 0.201
Schistosoma mansoni alpha-glucosidase 0.0149 0.1436 0.2701
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.0071 0.0069
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0045 0.0329 0.137
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0098 0.0887 0.1668
Toxoplasma gondii exonuclease III APE 0.0039 0.0256 0.1068
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0036 0.0225 0.0223
Schistosoma mansoni phosphatidylserine receptor 0.0015 0.0002 0.0004
Loa Loa (eye worm) transcription factor SMAD2 0.0522 0.5417 0.6478
Brugia malayi Smad1 0.0036 0.0225 0.0267
Brugia malayi MH1 domain containing protein 0.002 0.0055 0.0064
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.024 0.2401 0.2425
Plasmodium falciparum dihydroorotate dehydrogenase 0.024 0.2401 1
Trypanosoma brucei hypothetical protein, conserved 0.0027 0.0138 0.0569
Trichomonas vaginalis ap endonuclease, putative 0.0039 0.0256 0.0015
Echinococcus granulosus survival motor neuron protein 1 0.0798 0.8361 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0042 0.0289 0.1195
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0496 0.0932
Schistosoma mansoni alpha-glucosidase 0.0149 0.1436 0.2701
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.0396 0.1644
Schistosoma mansoni thyroid hormone receptor 0.0147 0.1413 0.2657
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.0071 0.0083
Brugia malayi jmjC domain containing protein 0.0055 0.0432 0.0515
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0256 0.2101
Echinococcus granulosus geminin 0.0502 0.52 0.6218
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0039 0.0256 0.2113
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0099 0.0116
Schistosoma mansoni tar DNA-binding protein 0.0092 0.0823 0.1548
Schistosoma mansoni intermediate filament proteins 0.0027 0.0133 0.025
Treponema pallidum exodeoxyribonuclease (exoA) 0.0039 0.0256 0.1248
Onchocerca volvulus 0.004 0.0271 0.1634
Brugia malayi MH2 domain containing protein 0.0522 0.5417 0.6478
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0045 0.0329 0.137
Brugia malayi beta-lactamase family protein 0.004 0.0271 0.0322
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0099 0.0068
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0039 0.0256 0.0304
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0071 0.0083
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.0071 0.0069
Schistosoma mansoni ap endonuclease 0.0039 0.0256 0.0482
Echinococcus granulosus histone acetyltransferase KAT2B 0.015 0.1443 0.1725
Entamoeba histolytica hypothetical protein 0.0051 0.0391 0.3922
Loa Loa (eye worm) hypothetical protein 0.0034 0.0208 0.0247
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0027 0.0138 0.0569
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0099 0.0068
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0027 0.0138 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0094 0.0843 1
Brugia malayi MH1 domain containing protein 0.002 0.0055 0.0064
Loa Loa (eye worm) hypothetical protein 0.0798 0.8361 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0496 0.0488
Schistosoma mansoni hypothetical protein 0.0163 0.1582 0.2976
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.0071 0.0083
Entamoeba histolytica hypothetical protein 0.0051 0.0391 0.3922
Mycobacterium ulcerans molybdopterin-guanine dinucleotide biosynthesis protein A 0.0116 0.1085 0.1113
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.0071 0.0083
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0126 0.1187 0.1418
Trichomonas vaginalis ap endonuclease, putative 0.0039 0.0256 0.0015
Loa Loa (eye worm) beta-lactamase 0.004 0.0271 0.0322
Echinococcus granulosus muscleblind protein 0.0509 0.5274 0.6308
Echinococcus granulosus mothers against decapentaplegic 6 0.0016 0.0015 0.0016
Mycobacterium tuberculosis Conserved protein 0.004 0.0271 0.0261
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0039 0.0256 0.0245
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.0256 0.0254
Brugia malayi nuclear receptor NHR-88 0.0021 0.0071 0.0083
Brugia malayi jmjC domain containing protein 0.0055 0.0432 0.0515
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0039 0.0256 0.1061
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0027 0.0138 0.012
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0138 0.1315 0.1313
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.0071 0.0134
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0027 0.0138 0.0576
Echinococcus multilocularis survival motor neuron protein 1 0.0798 0.8361 0.8361
Loa Loa (eye worm) hypothetical protein 0.0024 0.0099 0.0116
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0094 0.0843 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0116 0.1085 0.1123
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0154 0.149 0.1488
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0099 0.0079
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0271 0.0261
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0071 0.0069
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0099 0.0068
Onchocerca volvulus 0.0098 0.0887 0.5561
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.024 0.2401 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0055 0.0432 0.0515
Loa Loa (eye worm) hypothetical protein 0.0018 0.0035 0.004
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Echinococcus granulosus intermediate filament protein 0.0027 0.0133 0.0157
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.0071 0.0083
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0039 0.0256 0.1061
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.024 0.2401 1
Mycobacterium ulcerans hypothetical protein 0.0024 0.0099 0.0068
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0039 0.0256 0.1061
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.0071 0.0083
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0068 0.0573 0.1078
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.024 0.2401 1
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0027 0.0138 0.0109
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0071 0.0083
Onchocerca volvulus Protein ultraspiracle homolog 0.0021 0.0071 0.0357
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.0071 0.0083
Brugia malayi MH2 domain containing protein 0.0016 0.0015 0.0016
Entamoeba histolytica hypothetical protein 0.0027 0.0138 0.0525
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0396 0.1644
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0098 0.0887 0.1058
Brugia malayi ecdysteroid receptor 0.0021 0.0071 0.0083
Mycobacterium ulcerans lipase LipD 0.004 0.0271 0.025
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0496 0.0488
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.0071 0.0083
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0271 0.0261
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0271 0.1123
Brugia malayi steroid hormone receptor 0.0021 0.0071 0.0083
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.0071 0.0069
Schistosoma mansoni alpha glucosidase 0.0038 0.0256 0.0481
Entamoeba histolytica hypothetical protein 0.0051 0.0391 0.3922
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0271 0.0266
Brugia malayi TAR-binding protein 0.0092 0.0823 0.0982
Loa Loa (eye worm) hypothetical protein 0.0026 0.0128 0.015
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0163 0.1582 0.1891
Echinococcus multilocularis muscleblind protein 1 0.0509 0.5274 0.5274
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0271 0.0322
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.0071 0.0083
Schistosoma mansoni nuclear hormone receptor 0.0021 0.0071 0.0134
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0039 0.0256 0.1061
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0045 0.0329 0.1249
Echinococcus granulosus lamin 0.0027 0.0133 0.0157
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0154 0.149 0.2801
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.024 0.2401 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1315 0.2474
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0099 0.0406
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0015 0.0016
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0102 0.0937 0.0935
Echinococcus granulosus Smad4 0.0036 0.0225 0.0267
Schistosoma mansoni hypothetical protein 0.0502 0.52 0.9779
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0039 0.0256 0.0304
Schistosoma mansoni cellular tumor antigen P53 0.0034 0.0208 0.0392
Schistosoma mansoni jumonji domain containing protein 0.0055 0.0432 0.0813
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.0322
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.0071 0.0134
Echinococcus multilocularis tar DNA binding protein 0.0092 0.0823 0.0821
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0271 0.1123
Loa Loa (eye worm) hypothetical protein 0.0509 0.5274 0.6308
Echinococcus multilocularis muscleblind protein 0.0509 0.5274 0.5274
Loa Loa (eye worm) hypothetical protein 0.0021 0.0071 0.0083
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0094 0.0843 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0099 0.0068
Echinococcus multilocularis lysosomal alpha glucosidase 0.0173 0.1694 0.1692
Echinococcus granulosus TGF beta signal transducer SmadC 0.0036 0.0225 0.0267
Schistosoma mansoni dihydroorotate dehydrogenase 0.024 0.2401 0.4515
Echinococcus granulosus L aminoadipate semialdehyde 0.0098 0.0887 0.1058
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.024 0.2401 0.2869
Loa Loa (eye worm) TAR-binding protein 0.0092 0.0823 0.0982
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0271 0.0261
Echinococcus multilocularis lamin 0.0027 0.0133 0.0131
Schistosoma mansoni Smad4 0.0016 0.0015 0.0029
Onchocerca volvulus 0.0024 0.0099 0.0537
Brugia malayi hypothetical protein 0.0798 0.8361 1
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0015 0.0002 0.0008
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase 0.0902 0.9468 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.0256 0.0303
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0496 0.0488
Loa Loa (eye worm) hypothetical protein 0.0016 0.0015 0.0016
Brugia malayi RNA binding protein 0.0092 0.0823 0.0982
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0099 0.0068
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0099 0.0068
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0102 0.0937 0.0935
Leishmania major hypothetical protein, conserved 0.0052 0.0396 0.1644
Echinococcus multilocularis thyroid hormone receptor alpha 0.0147 0.1413 0.1411
Onchocerca volvulus 0.004 0.0271 0.1634
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0271 0.025
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.0099 0.0406
Loa Loa (eye worm) hypothetical protein 0.0098 0.0887 0.1058
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0036 0.0225 0.0423
Echinococcus multilocularis lysosomal alpha glucosidase 0.0173 0.1694 0.1692
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.024 0.2401 0.2456
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.0071 0.0134
Loa Loa (eye worm) MH1 domain-containing protein 0.0036 0.0225 0.0267
Schistosoma mansoni hypothetical protein 0.0051 0.0391 0.0736
Schistosoma mansoni lamin 0.0027 0.0133 0.025
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0015 0.0002 0.0008
Plasmodium falciparum ataxin-2 like protein, putative 0.0052 0.0396 0.1644
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0051 0.0391 0.0389
Schistosoma mansoni jumonji domain containing protein 0.0015 0.0002 0.0004
Leishmania major phosphopantetheinyl transferase-like protein 0.0027 0.0138 0.0569
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.0256 0.1057
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0102 0.0937 0.1762
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0094 0.0843 1
Echinococcus granulosus mothers against decapentaplegic 2 0.0016 0.0015 0.0016
Brugia malayi MH1 domain containing protein 0.0036 0.0225 0.0267
Leishmania major hypothetical protein, conserved 0.004 0.0271 0.1123
Mycobacterium leprae conserved hypothetical protein 0.004 0.0271 0.0183
Loa Loa (eye worm) hypothetical protein 0.002 0.0055 0.0064
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0071 0.0083
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0271 0.0261
Schistosoma mansoni tar DNA-binding protein 0.0092 0.0823 0.1548
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0051 0.0391 0.0466
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0045 0.0329 0.1363
Brugia malayi hypothetical protein 0.0052 0.0396 0.0472
Brugia malayi hypothetical protein 0.0033 0.0201 0.0238
Loa Loa (eye worm) hypothetical protein 0.0024 0.0099 0.0116
Brugia malayi RNA recognition motif domain containing protein 0.0092 0.0823 0.0982
Mycobacterium ulcerans hypothetical protein 0.0116 0.1085 0.1113
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0039 0.0256 0.0235
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0496 0.0932
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0061 0.0496 0.0498
Echinococcus multilocularis microtubule associated protein 2 0.0513 0.5317 0.5316
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.0071 0.0069
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0271 0.1123
Loa Loa (eye worm) hypothetical protein 0.0024 0.0099 0.0116
Schistosoma mansoni phd/f-box containing protein 0.0015 0.0002 0.0004
Schistosoma mansoni smad 0.0016 0.0015 0.0029
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.0071 0.0083
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.0071 0.0134
Schistosoma mansoni smad1 5 8 and 0.0036 0.0225 0.0423
Loa Loa (eye worm) hypothetical protein 0.0052 0.0396 0.0472
Brugia malayi beta-lactamase 0.004 0.0271 0.0322
Echinococcus multilocularis geminin 0.0502 0.52 0.5199
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0099 0.0116
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.0071 0.0069
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.0071 0.0083
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.0071 0.0083
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0133 0.0157
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.0071 0.0083
Echinococcus granulosus tumor protein p63 0.0232 0.2324 0.2778
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0092 0.0823 0.0982
Schistosoma mansoni survival motor neuron protein 0.0163 0.1582 0.2976
Toxoplasma gondii melibiase subfamily protein 0.0102 0.0937 0.3903
Loa Loa (eye worm) MH2 domain-containing protein 0.0522 0.5417 0.6478
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.0071 0.0083
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.0071 0.0083
Echinococcus multilocularis Smad4 0.0036 0.0225 0.0223
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0068 0.0573 0.1078
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0256 0.1057
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0255 0.2565 0.269
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0271 0.025
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0138 0.1315 0.1571
Loa Loa (eye worm) nuclear factor I 0.002 0.0055 0.0064
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.0071 0.0134
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0102 0.0937 0.1762
Loa Loa (eye worm) hypothetical protein 0.0018 0.0035 0.004
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.0071 0.0069
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.0071 0.0083
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.0071 0.0083
Schistosoma mansoni jumonji/arid domain-containing protein 0.0055 0.0432 0.0813
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.0071 0.0083
Trypanosoma cruzi PAB1-binding protein , putative 0.0052 0.0396 0.1644
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.0071 0.0083
Echinococcus granulosus FTZ F1 alpha 0.0021 0.0071 0.0083
Brugia malayi Glycosyl hydrolases family 31 protein 0.0038 0.0256 0.0303
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.024 0.2401 0.2869
Brugia malayi AMP-binding enzyme family protein 0.0024 0.0099 0.0116
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.0071 0.0083
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0094 0.0843 0.3507
Toxoplasma gondii LsmAD domain-containing protein 0.0052 0.0396 0.1651
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.0071 0.0083
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0015 0.0016
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0099 0.0068
Onchocerca volvulus 0.0021 0.0071 0.0357
Echinococcus multilocularis mothers against decapentaplegic 2 0.0016 0.0015 0.0013
Schistosoma mansoni hypothetical protein 0.0023 0.0093 0.0174
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 0.0902 0.9468 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.0071 0.0134
Echinococcus granulosus smad 0.0036 0.0225 0.0267
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0271 0.0266
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.0256 0.1065
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.0071 0.0083
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0133 0.0157
Echinococcus multilocularis mothers against decapentaplegic 5 0.0036 0.0225 0.0223
Echinococcus granulosus lysosomal alpha glucosidase 0.0173 0.1694 0.2024
Schistosoma mansoni lamin 0.0027 0.0133 0.025
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0099 0.0079
Toxoplasma gondii aldehyde dehydrogenase 0.0061 0.0496 0.2064
Brugia malayi Glycosyl hydrolases family 31 protein 0.0173 0.1694 0.2024
Mycobacterium leprae Probable lipase LipE 0.004 0.0271 0.0183
Loa Loa (eye worm) RNA binding protein 0.0092 0.0823 0.0982
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0035 0.0138
Loa Loa (eye worm) hypothetical protein 0.0018 0.0035 0.004
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0138 0.1315 0.2474
Brugia malayi Zinc finger, C2H2 type family protein 0.0094 0.0843 0.1006
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.0071 0.0083
Echinococcus multilocularis musashi 0.0027 0.0133 0.0131
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0256 0.1057
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.0071 0.0083
Loa Loa (eye worm) hypothetical protein 0.0018 0.0035 0.004
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0271 0.0261
Schistosoma mansoni Smad4 0.0036 0.0225 0.0423
Echinococcus multilocularis lamin dm0 0.0027 0.0133 0.0131
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0271 0.0266
Loa Loa (eye worm) MH2 domain-containing protein 0.0036 0.0225 0.0267

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) = 21.225 uM PUBCHEM_BIOASSAY: Bacterial Growth Inhibition Counterscreen using BacTiter-Glo Measured in Microorganism System Using Plate Reader - 2093-02_Inhibitor_Dose_CherryPick_Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488938] ChEMBL. No reference
Potency (functional) 0.0445 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

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

No literature references available for this target.

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