Detailed information for compound 1092011

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 281.263 | Formula: C16H11NO4
  • H donors: 0 H acceptors: 2 LogP: 1.82 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1coc2c1c(=O)oc1c2c(=O)n(c2c1cccc2)C
  • InChi: 1S/C16H11NO4/c1-8-7-20-14-11(8)16(19)21-13-9-5-3-4-6-10(9)17(2)15(18)12(13)14/h3-7H,1-2H3
  • InChiKey: DWEIFLZZXNRFMQ-UHFFFAOYSA-N  


Substructure search Similarity search

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
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0046 0.0154 0.1099
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0087 0.0418 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 1
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Plasmodium vivax ataxin-2 like protein, putative 0.0057 0.0228 0.5257
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0185 0.0171
Schistosoma mansoni ran 0.0025 0.0017 0.0003
Echinococcus granulosus peptidase Clp S14 family 0.0057 0.0225 0.0211
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Plasmodium vivax heat shock protein 86, putative 0.0036 0.009 0.1826
Leishmania major trypanothione reductase 0.0052 0.0196 0.6591
Schistosoma mansoni hypothetical protein 0.0054 0.0208 0.0194
Echinococcus granulosus RUN 0.0041 0.0125 0.0111
Schistosoma mansoni intermediate filament proteins 0.003 0.005 0.0036
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0046 0.0154 0.0388
Brugia malayi Latrophilin receptor protein 2 0.0054 0.0208 0.0536
Brugia malayi hypothetical protein 0.0041 0.0125 0.0306
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0185 0.0171
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Echinococcus multilocularis FTZ F1 alpha 0.0046 0.0154 0.014
Entamoeba histolytica heat shock protein 90, putative 0.0036 0.009 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0046 0.0154 0.0388
Echinococcus multilocularis importin subunit beta 1 0.0034 0.0074 0.006
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.003 0.005 0.0113
Onchocerca volvulus 0.0041 0.0125 0.0785
Trichomonas vaginalis heat shock protein, putative 0.0029 0.0043 0.4732
Echinococcus granulosus FTZ F1 alpha 0.0046 0.0154 0.014
Loa Loa (eye worm) steroid hormone receptor 0.0046 0.0154 0.0388
Leishmania major importin beta-1 subunit, putative 0.0027 0.0033 0.0598
Loa Loa (eye worm) hypothetical protein 0.0583 0.3624 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0054 0.0208 0.0194
Brugia malayi latrophilin 2 splice variant baaae 0.0117 0.0615 0.1664
Schistosoma mansoni hypothetical protein 0.0386 0.2348 0.2337
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0036 0.0089 0.0693
Loa Loa (eye worm) isocitrate dehydrogenase 0.0036 0.0089 0.0209
Trypanosoma cruzi heat shock protein 90, putative 0.0036 0.009 0.2693
Brugia malayi Kringle domain containing protein 0.0067 0.0289 0.0761
Loa Loa (eye worm) hypothetical protein 0.0117 0.0615 0.1664
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0089 0.0075
Echinococcus multilocularis tissue type plasminogen activator 0.0067 0.0289 0.0275
Loa Loa (eye worm) hypothetical protein 0.0054 0.0208 0.0536
Brugia malayi Importin beta-1 subunit 0.0034 0.0074 0.0167
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Loa Loa (eye worm) intermediate filament protein 0.003 0.005 0.0101
Plasmodium falciparum cysteine repeat modular protein 1 0.0067 0.0289 0.6912
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.012 0.063 0.872
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Onchocerca volvulus 0.0041 0.0125 0.0785
Schistosoma mansoni hypothetical protein 0.0359 0.2175 0.2164
Plasmodium falciparum glutathione reductase 0.0052 0.0196 0.4694
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0052 0.0196 0.2276
Onchocerca volvulus 0.0176 0.0995 1
Plasmodium vivax importin-beta 2, putative 0.0034 0.0074 0.143
Plasmodium vivax multidomain scavenger receptor, putative 0.0041 0.0125 0.2686
Giardia lamblia Heat shock protein HSP 90-alpha 0.0029 0.0043 0.3518
Echinococcus multilocularis heat shock protein 90 0.0036 0.009 0.0076
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0046 0.0154 0.014
Toxoplasma gondii heat shock protein HSP90 0.0036 0.009 0.1826
Brugia malayi Calcitonin receptor-like protein seb-1 0.0172 0.0965 0.2635
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0089 0.0075
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0026 0.0023 0.0009
Giardia lamblia Grp94/Hsp90 0.0029 0.0043 0.3518
Plasmodium falciparum ataxin-2 like protein, putative 0.0057 0.0228 0.5448
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0026 0.0023 0.0009
Trypanosoma brucei importin beta-1 subunit, putative 0.0034 0.0074 0.2721
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0248 0.1457 0.1445
Brugia malayi Endoplasmin precursor 0.0036 0.009 0.0211
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0046 0.0154 0.014
Echinococcus granulosus lipoxygenase domain containing protein 0.0041 0.0125 0.0111
Onchocerca volvulus Bile acid receptor homolog 0.0046 0.0154 0.1099
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0067 0.0289 0.6782
Brugia malayi RNA, U transporter 1 0.0096 0.0474 0.1276
Echinococcus multilocularis lipoxygenase domain containing protein 0.0041 0.0125 0.0111
Trypanosoma cruzi PAB1-binding protein , putative 0.0057 0.0228 0.7751
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0087 0.0418 0.0404
Echinococcus multilocularis microtubule associated protein 2 0.157 1 1
Echinococcus granulosus lipoxygenase domain containing protein 0.0041 0.0125 0.0111
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.012 0.063 0.872
Entamoeba histolytica hypothetical protein 0.0027 0.0033 0.2221
Echinococcus multilocularis isocitrate dehydrogenase 0.0036 0.0089 0.0075
Loa Loa (eye worm) hypothetical protein 0.0034 0.0074 0.0167
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0185 0.0171
Plasmodium vivax glutathione reductase, putative 0.0052 0.0196 0.447
Trichomonas vaginalis heat shock protein, putative 0.0029 0.0043 0.4732
Plasmodium falciparum thioredoxin reductase 0.0052 0.0196 0.4694
Loa Loa (eye worm) endoplasmin 0.0036 0.009 0.0211
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 1
Echinococcus granulosus lamin dm0 0.003 0.005 0.0036
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0046 0.0154 0.014
Mycobacterium tuberculosis Putative ferredoxin reductase 0.012 0.063 0.872
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0046 0.0154 0.0388
Echinococcus multilocularis lamin dm0 0.003 0.005 0.0036
Echinococcus multilocularis heat shock protein 0.0036 0.009 0.0076
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.0125 0.0306
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0046 0.0154 0.014
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.009 0.2693
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0046 0.0154 0.014
Brugia malayi Thioredoxin reductase 0.0052 0.0196 0.0504
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0046 0.0154 0.014
Plasmodium falciparum heat shock protein 90 0.0036 0.009 0.2157
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0025 0.0017 0.0008
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.003 0.005 0.0832
Trichomonas vaginalis ran, putative 0.0025 0.0017 0.1873
Echinococcus granulosus endoplasmin 0.0029 0.0043 0.0029
Echinococcus granulosus importin subunit beta 1 0.0034 0.0074 0.006
Entamoeba histolytica heat shock protein 90, putative 0.0036 0.009 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0036 0.0089 0.0075
Echinococcus granulosus GPCR family 2 0.0054 0.0208 0.0194
Loa Loa (eye worm) hypothetical protein 0.0057 0.0228 0.0592
Echinococcus granulosus tissue type plasminogen activator 0.0067 0.0289 0.0275
Echinococcus granulosus lamin 0.003 0.005 0.0036
Trypanosoma cruzi heat shock protein 90, putative 0.0029 0.0043 0.0947
Loa Loa (eye worm) TK/ROR protein kinase 0.0067 0.0289 0.0761
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.009 0.2693
Schistosoma mansoni endoplasmin 0.0036 0.009 0.0076
Echinococcus granulosus ecdysone induced protein 78C 0.0046 0.0154 0.014
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 1
Schistosoma mansoni hypothetical protein 0.0054 0.0208 0.0194
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0046 0.0154 0.014
Echinococcus granulosus snurportin 1 0.0359 0.2175 0.2164
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0036 0.0089 0.2138
Mycobacterium tuberculosis Probable dehydrogenase 0.012 0.063 0.872
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0185 0.0171
Schistosoma mansoni retinoic acid receptor RXR 0.0046 0.0154 0.014
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0087 0.0418 0.5565
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0036 0.0089 0.3437
Schistosoma mansoni hypothetical protein 0.0041 0.0125 0.0111
Trypanosoma cruzi importin beta-1 subunit, putative 0.0027 0.0033 0.0598
Schistosoma mansoni importin beta-1 0.0034 0.0074 0.006
Echinococcus multilocularis RUN 0.0041 0.0125 0.0111
Schistosoma mansoni hypothetical protein 0.0386 0.2348 0.2337
Mycobacterium tuberculosis Probable reductase 0.012 0.063 0.872
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0046 0.0154 0.014
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0046 0.0154 0.0388
Schistosoma mansoni lipoxygenase 0.0248 0.1457 0.1445
Echinococcus granulosus neuropeptide s receptor 0.1052 0.6654 0.6649
Loa Loa (eye worm) hypothetical protein 0.0136 0.0735 0.1998
Brugia malayi nuclear receptor NHR-88 0.0046 0.0154 0.0388
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0046 0.0154 0.0388
Schistosoma mansoni ran 0.0025 0.0017 0.0003
Trypanosoma brucei heat shock protein 90, putative 0.0036 0.009 0.3474
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0046 0.0154 0.014
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0029 0.0043 0.0029
Toxoplasma gondii isocitrate dehydrogenase 0.0036 0.0089 0.1807
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0087 0.0418 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0041 0.0125 0.0111
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0025 0.0017 0.0008
Echinococcus multilocularis peptidase Clp (S14 family) 0.0057 0.0225 0.0211
Schistosoma mansoni heat shock protein 0.0036 0.009 0.0076
Plasmodium falciparum importin beta, putative 0.0034 0.0074 0.1776
Schistosoma mansoni hypothetical protein 0.0026 0.0023 0.0009
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0046 0.0154 0.014
Echinococcus granulosus GTP binding nuclear protein Ran 0.0025 0.0017 0.0003
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.005 0.0101
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0054 0.0208 0.0536
Schistosoma mansoni endoplasmin 0.0036 0.009 0.0076
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0172 0.0965 0.2635
Schistosoma mansoni RAR-like nuclear receptor 0.0046 0.0154 0.014
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0036 0.0089 0.1807
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Loa Loa (eye worm) latrophilin receptor protein 2 0.0054 0.0208 0.0536
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0057 0.0225 0.2699
Echinococcus multilocularis heat shock protein 90 0.0029 0.0043 0.0029
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0046 0.0154 0.0388
Echinococcus granulosus Polycystic kidney disease protein 0.0041 0.0125 0.0111
Mycobacterium tuberculosis Probable oxidoreductase 0.0133 0.0717 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0054 0.0208 0.0194
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0046 0.0154 0.014
Schistosoma mansoni heat shock protein 0.0036 0.009 0.0076
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.012 0.063 0.872
Brugia malayi Steroid receptor seven-up type 2 0.0046 0.0154 0.0388
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 0.5
Schistosoma mansoni lamin 0.003 0.005 0.0036
Toxoplasma gondii heat shock protein 90, putative 0.0036 0.009 0.1826
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0046 0.0154 0.0388
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0057 0.0225 0.2699
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0046 0.0154 0.0388
Schistosoma mansoni steroid hormone receptor ad4bp 0.0046 0.0154 0.014
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Loa Loa (eye worm) hypothetical protein 0.0087 0.0418 0.1118
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.005 0.0101
Echinococcus granulosus heat shock protein 0.0036 0.009 0.0076
Brugia malayi hypothetical protein 0.0136 0.0735 0.1998
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0185 0.0171
Schistosoma mansoni lamin 0.003 0.005 0.0036
Trypanosoma cruzi PAB1-binding protein , putative 0.0057 0.0228 0.7751
Echinococcus granulosus intermediate filament protein 0.003 0.005 0.0036
Loa Loa (eye worm) heat shock protein 90 0.0036 0.009 0.0211
Echinococcus multilocularis neuropeptide receptor A26 0.1052 0.6654 0.6649
Schistosoma mansoni rab6-interacting 0.0041 0.0125 0.0111
Schistosoma mansoni hypothetical protein 0.0067 0.0289 0.0275
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.012 0.063 0.872
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0089 0.3437
Schistosoma mansoni hypothetical protein 0.0054 0.0208 0.0194
Toxoplasma gondii LsmAD domain-containing protein 0.0057 0.0228 0.5257
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Echinococcus multilocularis geminin 0.0386 0.2348 0.2337
Brugia malayi Protein kinase domain containing protein 0.0067 0.0289 0.0761
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0046 0.0154 0.0388
Schistosoma mansoni polycystin 1-related 0.0041 0.0125 0.0111
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0087 0.0418 0.0404
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0046 0.0154 0.014
Brugia malayi Isocitrate dehydrogenase 0.0036 0.0089 0.0209
Trypanosoma cruzi heat shock protein 85, putative 0.0029 0.0043 0.0947
Plasmodium falciparum ataxin-2 like protein, putative 0.0057 0.0228 0.5448
Schistosoma mansoni loxhd1 0.0041 0.0125 0.0111
Schistosoma mansoni hypothetical protein 0.0117 0.0615 0.0601
Brugia malayi glutathione reductase 0.0052 0.0196 0.0504
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.0033 0.3678
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0025 0.0017 0.0404
Loa Loa (eye worm) hypothetical protein 0.0041 0.0125 0.0306
Brugia malayi Probable ClpP-like protease 0.0087 0.0418 0.1118
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0025 0.0017 0.0003
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Loa Loa (eye worm) hypothetical protein 0.0172 0.0965 0.2635
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0046 0.0154 0.014
Loa Loa (eye worm) hypothetical protein 0.0029 0.0047 0.0091
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Trypanosoma brucei PAB1-binding protein , putative 0.0057 0.0228 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Brugia malayi Doublecortin family protein 0.0041 0.0125 0.0306
Brugia malayi ecdysteroid receptor 0.0046 0.0154 0.0388
Echinococcus multilocularis snurportin 1 0.0359 0.2175 0.2164
Schistosoma mansoni hypothetical protein 0.0054 0.0208 0.0194
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0046 0.0154 0.0388
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0089 0.2664
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0046 0.0154 0.014
Trypanosoma brucei heat shock protein 90, putative 0.0036 0.009 0.3474
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0046 0.0154 0.014
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 1
Schistosoma mansoni rab6-interacting 0.0041 0.0125 0.0111
Trichomonas vaginalis heat shock protein, putative 0.0029 0.0043 0.4732
Brugia malayi photoreceptor-specific nuclear receptor 0.0583 0.3624 1
Brugia malayi hypothetical protein 0.0176 0.0995 0.2717
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0087 0.0418 1
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Brugia malayi intermediate filament protein 0.003 0.005 0.0101
Trypanosoma cruzi Heat shock protein 83, putative 0.0036 0.009 0.2693
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0248 0.1457 0.1445
Schistosoma mansoni microtubule-associated protein tau 0.157 1 1
Plasmodium vivax endoplasmin, putative 0.0036 0.009 0.1826
Echinococcus multilocularis lipoxygenase domain containing protein 0.0041 0.0125 0.0111
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0196 0.6591
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0036 0.0089 0.2664
Toxoplasma gondii hypothetical protein 0.003 0.005 0.0832
Brugia malayi isocitrate dehydrogenase 0.0036 0.0089 0.0209
Echinococcus granulosus heat shock protein 90 0.0036 0.009 0.0076
Loa Loa (eye worm) hypothetical protein 0.0046 0.0154 0.0388
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Schistosoma mansoni coup transcription factor 0.0046 0.0154 0.014
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0046 0.0154 0.0388
Echinococcus multilocularis lamin 0.003 0.005 0.0036
Plasmodium vivax thioredoxin reductase, putative 0.0052 0.0196 0.447
Echinococcus granulosus heat shock protein 90 0.0029 0.0043 0.0029
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0036 0.0089 0.0075
Brugia malayi hypothetical protein 0.0041 0.0125 0.0306
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.009 0.2693
Loa Loa (eye worm) hypothetical protein 0.0176 0.0995 0.2717
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0046 0.0154 0.0388
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0036 0.0089 0.0075
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0046 0.0154 0.014
Onchocerca volvulus Huntingtin homolog 0.0136 0.0735 0.7252
Loa Loa (eye worm) glutathione reductase 0.0052 0.0196 0.0504
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0196 0.0182
Trypanosoma cruzi hypothetical protein, conserved 0.0067 0.0289 1
Onchocerca volvulus 0.0067 0.0289 0.2523
Giardia lamblia Heat shock protein HSP 90-alpha 0.0036 0.009 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0046 0.0154 0.014
Trypanosoma brucei importin beta-1 subunit, putative 0.0034 0.0074 0.2721
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0046 0.0154 0.0388
Toxoplasma gondii isocitrate dehydrogenase 0.0036 0.0089 0.1807
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0196 0.0182
Onchocerca volvulus Protein ultraspiracle homolog 0.0046 0.0154 0.1099
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0133 0.0717 1
Toxoplasma gondii thioredoxin reductase 0.0052 0.0196 0.447
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0172 0.0965 0.2635
Onchocerca volvulus 0.0046 0.0154 0.1099
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Schistosoma mansoni nuclear hormone receptor 0.0046 0.0154 0.014
Trypanosoma brucei Heat shock protein 83, putative 0.0036 0.009 0.3474
Brugia malayi hypothetical protein 0.0037 0.0096 0.0228
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.003 0.005 0.1202
Echinococcus granulosus neuropeptide receptor A26 0.1052 0.6654 0.6649
Brugia malayi steroid hormone receptor 0.0046 0.0154 0.0388
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0046 0.0154 0.014
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0029 0.0043 0.0947
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0046 0.0154 0.014
Brugia malayi Nuclear hormone receptor-like 1 0.0046 0.0154 0.0388
Toxoplasma gondii kringle domain-containing protein 0.0067 0.0289 0.6782
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0054 0.0208 0.0194
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0046 0.0154 0.0388
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0046 0.0154 0.0388
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0046 0.0154 0.0388
Trypanosoma brucei heat shock protein, putative 0.0036 0.009 0.3474
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0046 0.0154 0.0388
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0185 0.0171
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0185 0.0474
Toxoplasma gondii HEAT repeat-containing protein 0.0034 0.0074 0.143
Onchocerca volvulus Huntingtin homolog 0.0136 0.0735 0.7252
Trichomonas vaginalis importin beta-1, putative 0.0027 0.0033 0.3678
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0057 0.0225 0.2699
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Leishmania major hypothetical protein, conserved 0.0057 0.0228 0.7751
Schistosoma mansoni peptidase Clp (S14 family) 0.0087 0.0418 0.0404
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0185 0.0171
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0027 0.0033 0.3678
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Echinococcus multilocularis endoplasmin 0.0029 0.0043 0.0029
Brugia malayi hypothetical protein 0.0057 0.0228 0.0592
Brugia malayi heat shock protein 90 0.0036 0.009 0.0211
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0196 0.0504
Loa Loa (eye worm) doublecortin family protein 0.0041 0.0125 0.0306
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0185 0.0474
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0133 0.0717 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0133 0.0717 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0036 0.0089 0.2664
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0046 0.0154 0.0388
Echinococcus multilocularis thyroid hormone receptor alpha 0.0046 0.0154 0.014
Leishmania major heat shock protein 83-1 0.0036 0.009 0.2693
Loa Loa (eye worm) hypothetical protein 0.003 0.005 0.0101
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0054 0.0208 0.0194
Trypanosoma brucei trypanothione reductase 0.0052 0.0196 0.8504
Echinococcus multilocularis GPCR, family 2 0.0054 0.0208 0.0194
Plasmodium falciparum LCCL domain-containing protein 0.0041 0.0125 0.2981
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0087 0.0418 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0046 0.0154 0.0388
Schistosoma mansoni thyroid hormone receptor 0.0046 0.0154 0.014
Echinococcus multilocularis neuropeptide s receptor 0.1052 0.6654 0.6649
Leishmania major hypothetical protein, conserved 0.0067 0.0289 1
Trichomonas vaginalis heat shock protein, putative 0.0036 0.009 1
Echinococcus multilocularis musashi 0.003 0.005 0.0036
Brugia malayi nuclear hormone receptor 0.0046 0.0154 0.0388
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.003 0.005 0.0202
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0359 0.2175 0.5986
Echinococcus granulosus geminin 0.0386 0.2348 0.2337
Loa Loa (eye worm) hypothetical protein 0.0136 0.0735 0.1998
Schistosoma mansoni thyroid hormone receptor 0.0046 0.0154 0.014
Loa Loa (eye worm) hypothetical protein 0.0067 0.0289 0.0761
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0046 0.0154 0.0388
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0036 0.0089 0.0075
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0046 0.0154 0.014
Schistosoma mansoni lipoxygenase 0.0173 0.0975 0.0963

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 11 ug ml-1 Growth inhibition of human MCF7 cells after 72 hrs by SRB assay ChEMBL. 20148565
ED50 (functional) = 12 ug ml-1 Growth inhibition of human SK-BR-3 cells after 72 hrs by SRB assay ChEMBL. 20148565

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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