Detailed information for compound 1670556

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 347.796 | Formula: C8H14ClN3O6S2
  • H donors: 1 H acceptors: 6 LogP: -0.48 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: ClCCN(C(=O)N[C@@H]1CS(=O)(=O)[C@@H](S(=O)(=O)C1)C)N=O
  • InChi: 1S/C8H14ClN3O6S2/c1-6-19(15,16)4-7(5-20(6,17)18)10-8(13)12(11-14)3-2-9/h6-7H,2-5H2,1H3,(H,10,13)/t6-,7+
  • InChiKey: YXUZPTFACYZZBL-KNVOCYPGSA-N  

Network

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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 guanine nucleotide binding protein G(s) subunit 0.0082 0.027 0.027
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0085 0.028 0.0745
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Echinococcus granulosus geminin 0.0461 0.1977 0.8717
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Loa Loa (eye worm) hypothetical protein 0.0045 0.01 0.0266
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Schistosoma mansoni 3-dehydroquinate synthase 0.0268 0.1108 0.4886
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0028 0.0026 0.0458
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0082 0.027 0.119
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0112 0.0404 0.3497
Brugia malayi ecdysteroid receptor 0.0855 0.3759 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0005 0.0012
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.004 0.0078 0.0345
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0082 0.0268 0.0268
Brugia malayi conserved hypotetical protein 0.004 0.0078 0.0208
Brugia malayi hypothetical protein 0.0141 0.0536 0.1426
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0085 0.028 0.028
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.004 0.0078 0.0078
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0126 0.0465 0.0465
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0082 0.027 0.119
Brugia malayi nuclear receptor RXR 0.004 0.0078 0.0208
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0126 0.0465 0.1238
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0085 0.028 0.028
Onchocerca volvulus 0.0085 0.028 0.0718
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0101 0.0353 0.3027
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0085 0.028 0.1235
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0028 0.0026 0.0026
Echinococcus granulosus thyroid hormone receptor alpha 0.004 0.0078 0.0345
Echinococcus multilocularis lysine specific demethylase 5A 0.003 0.0035 0.0035
Echinococcus granulosus lysine specific demethylase 5A 0.003 0.0035 0.0153
Brugia malayi ecdysone receptor 0.004 0.0078 0.0208
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0082 0.027 0.119
Loa Loa (eye worm) isocitrate dehydrogenase 0.0028 0.0026 0.0068
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0085 0.028 0.1235
Plasmodium falciparum phd finger protein, putative 0.0025 0.0011 0.0687
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0028 0.0026 0.2267
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0085 0.028 0.0745
Loa Loa (eye worm) glutathione reductase 0.0044 0.0098 0.026
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0421 0.1797 0.3676
Echinococcus granulosus transcription factor Dp 1 0.0073 0.0226 0.0998
Brugia malayi nuclear receptor NHR-88 0.0085 0.028 0.0745
Loa Loa (eye worm) steroid hormone receptor 0.0085 0.028 0.0745
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0085 0.028 0.0718
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.004 0.0078 0.0345
Mycobacterium tuberculosis Probable dehydrogenase 0.0101 0.0353 0.3027
Brugia malayi Bromodomain containing protein 0.0025 0.0011 0.0029
Plasmodium falciparum glutathione reductase 0.0044 0.0098 1
Loa Loa (eye worm) transcription factor SMAD2 0.0332 0.1396 0.3713
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Mycobacterium tuberculosis 3-dehydroquinate synthase AroB 0.0268 0.1108 1
Loa Loa (eye worm) thioredoxin reductase 0.0044 0.0098 0.026
Echinococcus multilocularis jumonji domain containing protein 0.0035 0.0055 0.0055
Schistosoma mansoni hypothetical protein 0.0461 0.1977 0.8717
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0085 0.028 0.0745
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0085 0.028 0.1235
Plasmodium vivax glutathione reductase, putative 0.0044 0.0098 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.004 0.0078 0.0078
Brugia malayi Nuclear hormone receptor E75 0.004 0.0078 0.0208
Schistosoma mansoni zinc finger protein 0.004 0.0078 0.0345
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0028 0.0026 0.0458
Brugia malayi MH2 domain containing protein 0.0332 0.1396 0.3713
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0689 0.3007 1
Loa Loa (eye worm) DR-78 0.004 0.0078 0.0208
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0028 0.0026 0.0458
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0025 0.0011 0.0049
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0085 0.028 0.0745
Echinococcus multilocularis ecdysone induced protein 78C 0.0085 0.028 0.028
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0085 0.028 0.028
Brugia malayi Thioredoxin reductase 0.0044 0.0098 0.026
Brugia malayi isocitrate dehydrogenase 0.0028 0.0026 0.0068
Brugia malayi nuclear receptor RXR 0.0045 0.01 0.0266
Onchocerca volvulus Protein ultraspiracle homolog 0.0085 0.028 0.0718
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0126 0.0465 0.2052
Echinococcus granulosus Nuclear hormone receptor HR96 0.004 0.0078 0.0345
Loa Loa (eye worm) nuclear receptor NHR-67 0.004 0.0078 0.0208
Loa Loa (eye worm) hypothetical protein 0.0045 0.01 0.0266
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0045 0.01 0.044
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Brugia malayi Steroid receptor seven-up type 2 0.0085 0.028 0.0745
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0028 0.0026 0.0458
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0101 0.0353 0.3027
Echinococcus granulosus nuclear receptor 2DBD gamma 0.004 0.0078 0.0345
Schistosoma mansoni nuclear hormone receptor 0.004 0.0078 0.0345
Echinococcus multilocularis geminin 0.0461 0.1977 0.1977
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0525 0.2268 1
Schistosoma mansoni glutaminase 0.0265 0.1094 0.4822
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0085 0.028 0.0745
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0028 0.0026 0.2267
Brugia malayi hypothetical protein 0.0045 0.01 0.0266
Brugia malayi Nuclear hormone receptor-like 1 0.0045 0.01 0.0266
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.004 0.0078 0.0179
Brugia malayi steroid hormone receptor 0.0085 0.028 0.0745
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0085 0.028 0.028
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0085 0.028 0.0745
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0126 0.0465 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0092 0.0244
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0024 0.0005 0.002
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Giardia lamblia PHD finger protein 15 0.0025 0.0011 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0082 0.027 0.0718
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0085 0.028 0.028
Loa Loa (eye worm) jmjC domain-containing protein 0.0052 0.0131 0.035
Brugia malayi hypothetical protein 0.0045 0.01 0.0266
Toxoplasma gondii PHD-finger domain-containing protein 0.0025 0.0011 0.0021
Brugia malayi orphan nuclear receptor NR2E1 0.004 0.0078 0.0208
Echinococcus multilocularis transcription factor Dp 1 0.0073 0.0226 0.0226
Schistosoma mansoni steroid hormone receptor ad4bp 0.0085 0.028 0.1235
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0045 0.01 0.0266
Brugia malayi hypothetical protein 0.004 0.0078 0.0208
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0085 0.028 0.1235
Echinococcus multilocularis peregrin 0.0025 0.0011 0.0011
Plasmodium falciparum thioredoxin reductase 0.0044 0.0098 1
Echinococcus multilocularis 0.0024 0.0005 0.0005
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0085 0.028 0.0745
Echinococcus granulosus jumonji domain containing protein 0.0035 0.0055 0.0244
Schistosoma mansoni retinoic acid receptor RXR 0.0525 0.2268 1
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0689 0.3007 1
Brugia malayi hypothetical protein 0.004 0.0078 0.0208
Trypanosoma brucei trypanothione reductase 0.0044 0.0098 0.2018
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0112 0.0404 0.0192
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0085 0.028 0.0745
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0044 0.0098 0.0664
Schistosoma mansoni hypothetical protein 0.0461 0.1977 0.8717
Schistosoma mansoni thyroid hormone receptor 0.0085 0.028 0.1235
Brugia malayi tailless protein 0.004 0.0078 0.0208
Leishmania major trypanothione reductase 0.0044 0.0098 0.2018
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0028 0.0026 0.0458
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0085 0.028 0.1235
Loa Loa (eye worm) glutaminase 0.0265 0.1094 0.2909
Schistosoma mansoni hypothetical protein 0.0025 0.0011 0.0049
Loa Loa (eye worm) jmjC domain-containing protein 0.003 0.0035 0.0093
Brugia malayi nuclear hormone receptor family member nhr-6 0.004 0.0078 0.0208
Echinococcus granulosus ecdysone induced protein 78C 0.0085 0.028 0.1235
Brugia malayi glutaminase DH11.1 0.0265 0.1094 0.2909
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0085 0.028 0.0745
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0085 0.028 0.1235
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0028 0.0026 0.0113
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0126 0.0465 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0085 0.028 0.0745
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0045 0.01 0.044
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.004 0.0078 0.0208
Brugia malayi Nuclear hormone receptor-like 1 0.0045 0.01 0.0266
Echinococcus multilocularis thyroid hormone receptor alpha 0.0085 0.028 0.028
Trichomonas vaginalis glutaminase, putative 0.0265 0.1094 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0028 0.0026 0.0026
Brugia malayi nuclear receptor NHR-88 0.004 0.0078 0.0208
Brugia malayi Isocitrate dehydrogenase 0.0028 0.0026 0.0068
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0126 0.0465 0.2052
Schistosoma mansoni jumonji domain containing protein 0.0065 0.0192 0.0847
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0101 0.0353 0.3027
Echinococcus granulosus Nuclear hormone receptor HR96 0.004 0.0078 0.0345
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0085 0.028 0.1235
Toxoplasma gondii isocitrate dehydrogenase 0.0028 0.0026 0.007
Schistosoma mansoni coup transcription factor 0.0085 0.028 0.1235
Loa Loa (eye worm) hypothetical protein 0.0045 0.01 0.0266
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0082 0.027 0.027
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Loa Loa (eye worm) glutaminase 2 0.0265 0.1094 0.2909
Mycobacterium leprae 3-dehydroquinate synthase AroB 0.0268 0.1108 0.2844
Loa Loa (eye worm) nuclear receptor nhr-7B 0.004 0.0078 0.0208
Echinococcus multilocularis Carboxy terminal domain RNA polymerase II 0.0024 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Echinococcus multilocularis PHD finger protein rhinoceros 0.0025 0.0011 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0085 0.028 0.0745
Toxoplasma gondii isocitrate dehydrogenase 0.0028 0.0026 0.007
Brugia malayi nuclear receptor NHR-67 0.004 0.0078 0.0208
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.048 0.2066 0.2066
Brugia malayi nuclear hormone receptor 0.0085 0.028 0.0745
Brugia malayi Nuclear hormone receptor-like 1 0.0085 0.028 0.0745
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0085 0.028 0.0745
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0421 0.1797 0.5
Loa Loa (eye worm) hypothetical protein 0.0045 0.01 0.0266
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.004 0.0078 0.0078
Echinococcus multilocularis isocitrate dehydrogenase 0.0028 0.0026 0.0026
Schistosoma mansoni nuclear hormone receptor 0.004 0.0078 0.0345
Echinococcus multilocularis thioredoxin glutathione reductase 0.0044 0.0098 0.0098
Toxoplasma gondii PHD-finger domain-containing protein 0.0025 0.0011 0.0021
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0126 0.0465 0.1238
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Schistosoma mansoni jumonji/arid domain-containing protein 0.003 0.0035 0.0153
Brugia malayi photoreceptor-specific nuclear receptor 0.0085 0.028 0.0745
Schistosoma mansoni nuclear receptor nhr-48 0.004 0.0078 0.0345
Onchocerca volvulus 0.004 0.0078 0.0179
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0126 0.0465 1
Brugia malayi glutathione reductase 0.0044 0.0098 0.026
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.004 0.0078 0.0345
Brugia malayi nuclear hormone receptor family member odr-7 0.004 0.0078 0.0208
Schistosoma mansoni thyroid hormone receptor 0.0085 0.028 0.1235
Brugia malayi Carboxy-terminal domain RNA polymerase II polypeptide A smallphosphatase 1 0.0024 0.0005 0.0012
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0028 0.0026 0.0026
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.004 0.0078 0.0179
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0085 0.028 0.0745
Schistosoma mansoni nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if) 0.0024 0.0005 0.002
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0101 0.0353 0.3027
Loa Loa (eye worm) MH2 domain-containing protein 0.0332 0.1396 0.3713
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Onchocerca volvulus 0.0141 0.0536 0.1401
Echinococcus granulosus CTD small phosphatase protein like 0.0024 0.0005 0.002
Brugia malayi Nuclear hormone receptor E75 0.004 0.0078 0.0208
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0045 0.01 0.01
Loa Loa (eye worm) hypothetical protein 0.0045 0.01 0.0266
Onchocerca volvulus 0.004 0.0078 0.0179
Loa Loa (eye worm) hypothetical protein 0.0141 0.0536 0.1426
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0011 0.0029
Schistosoma mansoni nuclear hormone receptor 0.0085 0.028 0.1235
Echinococcus multilocularis Nuclear hormone receptor HR96 0.004 0.0078 0.0078
Chlamydia trachomatis UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0421 0.1797 0.3627
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0085 0.028 0.028
Plasmodium vivax hypothetical protein, conserved 0.0025 0.0011 0.0687
Onchocerca volvulus Bile acid receptor homolog 0.0855 0.3759 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0126 0.0465 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0085 0.028 0.0745
Loa Loa (eye worm) hypothetical protein 0.0855 0.3759 1
Schistosoma mansoni nuclear receptor 0.004 0.0078 0.0345
Brugia malayi PHD-finger family protein 0.0025 0.0011 0.0029
Echinococcus multilocularis nuclear receptor nhr 48 0.004 0.0078 0.0078
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0085 0.028 0.0745
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0126 0.0465 1
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0085 0.028 0.1235
Echinococcus granulosus FTZ F1 alpha 0.0085 0.028 0.1235
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0085 0.028 0.1235
Echinococcus granulosus PHD finger protein rhinoceros 0.0025 0.0011 0.0049
Echinococcus multilocularis FTZ F1 alpha 0.0085 0.028 0.028
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0112 0.0404 0.3497
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0045 0.01 0.044
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0085 0.028 0.0745
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0082 0.027 0.119
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0082 0.0268 0.1183
Plasmodium vivax thioredoxin reductase, putative 0.0044 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0011 0.0029
Loa Loa (eye worm) hypothetical protein 0.0023 0.0003 0.0009
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0082 0.027 0.119
Echinococcus granulosus thioredoxin glutathione reductase 0.0044 0.0098 0.043
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0689 0.3007 1
Brugia malayi jmjC domain containing protein 0.003 0.0035 0.0093
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0085 0.028 0.0745
Toxoplasma gondii thioredoxin reductase 0.0044 0.0098 0.031
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0085 0.028 0.1235
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0085 0.028 0.0745
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0421 0.1797 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0085 0.028 0.0745
Mycobacterium ulcerans 3-dehydroquinate synthase 0.0268 0.1108 0.0077
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0689 0.3007 1
Schistosoma mansoni RAR-like nuclear receptor 0.0085 0.028 0.1235
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0082 0.027 0.0718
Brugia malayi jmjC domain containing protein 0.0082 0.0268 0.0714
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0028 0.0026 0.0113
Schistosoma mansoni nuclear receptor 0.004 0.0078 0.0345
Brugia malayi nuclear hormone receptor 0.004 0.0078 0.0208
Mycobacterium tuberculosis Probable reductase 0.0101 0.0353 0.3027
Schistosoma mansoni hypothetical protein 0.0023 0.0003 0.0015
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0085 0.028 0.0745
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0028 0.0026 0.0026
Mycobacterium tuberculosis Probable oxidoreductase 0.0112 0.0404 0.3497
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0085 0.028 0.1235
Mycobacterium tuberculosis 3-phosphoshikimate 1-carboxyvinyltransferase AroA (5-enolpyruvylshikimate-3-phosphate synthase) (EPSP synthase) (EPSPS) 0.0268 0.1108 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0078 0.0208
Echinococcus granulosus peregrin 0.0025 0.0011 0.0049
Schistosoma mansoni jumonji/arid domain-containing protein 0.003 0.0035 0.0153
Loa Loa (eye worm) hypothetical protein 0.0085 0.028 0.0745
Echinococcus granulosus Carboxy terminal domain RNA polymerase II 0.0024 0.0005 0.002
Loa Loa (eye worm) nuclear hormone receptor 0.004 0.0078 0.0208
Echinococcus granulosus nuclear receptor nhr 48 0.004 0.0078 0.0345
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0085 0.028 0.1235
Trypanosoma cruzi trypanothione reductase, putative 0.0044 0.0098 0.2018

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 18 mg kg-1 Antitumor activity against mouse L1210 cells allografted in ip dosed BDF1 mouse assessed as increase of life span of host measured up to 45 days ChEMBL. 836500
LD10 (ADMET) = 1.04 M kg-1 Toxicity against L-1210 leukemia cells in mice after intraperitoneal administration, activity is expressed as LD10 ChEMBL. 7420354

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

No literature references available for this target.

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