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  


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

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.
 
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.