Detailed information for compound 1310934

Basic information

Technical information
  • TDR Targets ID: 1310934
  • Name: T5566012
  • MW: 310.347 | Formula: C18H18N2O3
  • H donors: 1 H acceptors: 3 LogP: 3.67 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc(c(c1)[N+](=O)[O-])C)NC1CCCc2c1cccc2
  • InChi: 1S/C18H18N2O3/c1-12-9-10-14(11-17(12)20(22)23)18(21)19-16-8-4-6-13-5-2-3-7-15(13)16/h2-3,5,7,9-11,16H,4,6,8H2,1H3,(H,19,21)
  • InChiKey: KVYKZOIBYUNRJQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references
Homo sapiens isocitrate dehydrogenase 1 (NADP+), soluble Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens apolipoprotein B mRNA editing enzyme, catalytic polypeptide-like 3G Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma brucei isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum Isocitrate dehydrogenase-like protein, related Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans C terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Theileria parva isocitrate dehydrogenase (NADP+), putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium berghei isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Candida albicans cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania donovani isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium knowlesi isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania infantum isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans N terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Babesia bovis isocitrate dehydrogenase, NADP-dependent family protein Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania braziliensis isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania mexicana isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum hypothetical protein Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi Isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma mansoni NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Toxoplasma gondii intraflagellar transport protein 172, putative glycoprotein hormones, alpha polypeptide 116 aa 94 aa 26.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0241 0.0271
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0241 0.0241
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0091 0.0091
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0241 0.0271
Loa Loa (eye worm) hypothetical protein 0.0025 0.1002 0.1128
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0688 0.0688
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.1002 0.3897
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0241 0.0271
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0241 0.0271
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0241 0.0241
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.2476 1
Echinococcus multilocularis GPCR, family 2 0.0016 0.0527 0.0527
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.0688 0.0688
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0091 0.0091
Entamoeba histolytica transcription factor BTF3, putative 0.0035 0.1495 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0241 0.0271
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0241 0.0241
Trypanosoma cruzi transcription factor btf3, putative 0.0035 0.1495 1
Brugia malayi ecdysteroid receptor 0.001 0.0241 0.0271
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0241 0.0241
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0241 0.0271
Schistosoma mansoni tar DNA-binding protein 0.0076 0.357 0.357
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.1495 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0241 0.0241
Schistosoma mansoni hypothetical protein 0.0205 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0241 0.0271
Brugia malayi TAR-binding protein 0.0076 0.357 0.4016
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0241 0.0241
Entamoeba histolytica hypothetical protein 0.0035 0.1495 0.5
Schistosoma mansoni thyroid hormone receptor 0.001 0.0241 0.0241
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.2246 0.2527
Brugia malayi nuclear receptor NHR-88 0.001 0.0241 0.0271
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0179 0.0201
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0241 0.0241
Schistosoma mansoni hypothetical protein 0.0016 0.0527 0.0527
Schistosoma mansoni hypothetical protein 0.0011 0.0301 0.0301
Plasmodium vivax basic transcription factor 3b, putative 0.0035 0.1495 1
Echinococcus granulosus FTZ F1 alpha 0.001 0.0241 0.0241
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0241 0.0241
Brugia malayi isocitrate dehydrogenase 0.0019 0.0688 0.0774
Brugia malayi nuclear hormone receptor 0.001 0.0241 0.0271
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0241 0.0271
Echinococcus granulosus muscleblind protein 0.015 0.7268 0.7268
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.2246 0.2527
Brugia malayi RNA binding protein 0.0076 0.357 0.4016
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0241 0.0271
Echinococcus multilocularis tar DNA binding protein 0.0076 0.357 0.357
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0241 0.0271
Onchocerca volvulus 0.0182 0.8888 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.0688 0.0774
Loa Loa (eye worm) hypothetical protein 0.0016 0.0527 0.0592
Echinococcus multilocularis cpg binding protein 0.0031 0.1262 0.1262
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.145 0.1632
Schistosoma mansoni tar DNA-binding protein 0.0076 0.357 0.357
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0241 0.0271
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0241 0.0271
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0179 0.0179
Schistosoma mansoni tar DNA-binding protein 0.0076 0.357 0.357
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.1495 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0179 0.0179
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0241 0.0241
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.1002 0.3897
Echinococcus multilocularis geminin 0.0205 1 1
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0091 0.0091
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0241 0.0241
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.1002 0.3897
Onchocerca volvulus 0.0029 0.118 0.1086
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Schistosoma mansoni hypothetical protein 0.0016 0.0527 0.0527
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.0688 0.0688
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0241 0.0271
Brugia malayi Muscleblind-like protein 0.015 0.7268 0.8177
Loa Loa (eye worm) ICD-1 protein 0.0035 0.1495 0.1682
Toxoplasma gondii NAC domain-containing protein 0.0035 0.1495 0.4512
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0241 0.0241
Echinococcus multilocularis transcription factor btf3 0.0035 0.1495 0.1495
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.357 0.4016
Brugia malayi hypothetical protein 0.0182 0.8888 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0241 0.0241
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.2246 0.2527
Schistosoma mansoni coup transcription factor 0.001 0.0241 0.0241
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0241 0.0241
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0241 0.0271
Schistosoma mansoni cpg binding protein 0.0029 0.118 0.118
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0241 0.0241
Echinococcus granulosus GPCR family 2 0.0016 0.0527 0.0527
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0527 0.0527
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.1002 0.3897
Loa Loa (eye worm) hypothetical protein 0.0034 0.145 0.1632
Echinococcus multilocularis muscleblind protein 0.015 0.7268 0.7268
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0527 0.0527
Loa Loa (eye worm) hypothetical protein 0.005 0.2246 0.2527
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0241 0.0241
Schistosoma mansoni thyroid hormone receptor 0.001 0.0241 0.0241
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0241 0.0271
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0241 0.0241
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0301 0.0301
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.1002 0.1758
Plasmodium falciparum basic transcription factor 3b, putative 0.0035 0.1495 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0688 0.0688
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0527 0.0527
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0301 0.0301
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.1002 0.3897
Trypanosoma brucei transcription factor BTF3, putative 0.0035 0.1495 1
Trypanosoma cruzi transcription factor btf3, putative 0.0035 0.1495 1
Loa Loa (eye worm) hypothetical protein 0.0182 0.8888 1
Loa Loa (eye worm) hypothetical protein 0.015 0.7268 0.8177
Schistosoma mansoni hypothetical protein 0.0016 0.0527 0.0527
Schistosoma mansoni hypothetical protein 0.0016 0.0527 0.0527
Schistosoma mansoni transcription factor btf3 0.0035 0.1495 0.1495
Echinococcus granulosus transcription factor btf3 0.0035 0.1495 0.1495
Schistosoma mansoni nuclear hormone receptor 0.001 0.0241 0.0241
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0241 0.0271
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0.0688 0.5
Schistosoma mansoni cpg binding protein 0.0031 0.1262 0.1262
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0091 0.0091
Brugia malayi CXXC zinc finger family protein 0.0029 0.118 0.1327
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0241 0.0241
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0241 0.0271
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0527 0.0592
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0241 0.0241
Brugia malayi steroid hormone receptor 0.001 0.0241 0.0271
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0241 0.0241
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.0688 0.0688
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0241 0.0271
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0241 0.0241
Leishmania major hypothetical protein, conserved 0.0025 0.1002 0.3897
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0091 0.0091
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0527 0.0592
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0241 0.0271
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0241 0.0241
Schistosoma mansoni tar DNA-binding protein 0.0076 0.357 0.357
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0241 0.0271
Brugia malayi hypothetical protein 0.0025 0.1002 0.1128
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0241 0.0241
Leishmania major basic transcription factor 3a, putative 0.0035 0.1495 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0241 0.0241
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0527 0.0592
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0688 0.0688
Schistosoma mansoni tar DNA-binding protein 0.0076 0.357 0.357
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0173 0.0195
Loa Loa (eye worm) hypothetical protein 0.015 0.7268 0.8177
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.357 0.4016
Schistosoma mansoni cpg binding protein 0.0031 0.1262 0.1262
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0527 0.0527
Schistosoma mansoni hypothetical protein 0.0034 0.145 0.145
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0241 0.0241
Schistosoma mansoni hypothetical protein 0.0205 1 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.118 0.1327
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0241 0.0271
Echinococcus granulosus tar DNA binding protein 0.0076 0.357 0.357
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0241 0.0241
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0241 0.0271
Brugia malayi hypothetical protein 0.0016 0.0552 0.0621
Loa Loa (eye worm) RNA binding protein 0.0076 0.357 0.4016
Loa Loa (eye worm) hypothetical protein 0.001 0.0241 0.0271
Echinococcus multilocularis muscleblind protein 1 0.015 0.7268 0.7268
Brugia malayi Isocitrate dehydrogenase 0.0019 0.0688 0.0774
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.1002 0.3897
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.1495 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.0688 0.0688
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.2804 0.2804
Loa Loa (eye worm) TAR-binding protein 0.0076 0.357 0.4016
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0241 0.0271
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0241 0.0241
Brugia malayi beta-NAC-like protein 0.0035 0.1495 0.1682
Echinococcus granulosus cpg binding protein 0.0031 0.1262 0.1262
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0241 0.0271

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 7.0795 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
Potency (functional) 10 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.9953 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.9953 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.081 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
Plasmodium falciparum 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.

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