Detailed information for compound 1263005

Basic information

Technical information
  • TDR Targets ID: 1263005
  • Name: 2-(4-chloro-2-methylphenoxy)-N-[(5-chloropyri din-2-yl)carbamothioyl]acetamide
  • MW: 370.254 | Formula: C15H13Cl2N3O2S
  • H donors: 2 H acceptors: 2 LogP: 4.44 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(NC(=S)Nc1ccc(cn1)Cl)COc1ccc(cc1C)Cl
  • InChi: 1S/C15H13Cl2N3O2S/c1-9-6-10(16)2-4-12(9)22-8-14(21)20-15(23)19-13-5-3-11(17)7-18-13/h2-7H,8H2,1H3,(H2,18,19,20,21,23)
  • InChiKey: OUXCSIKILUPUKX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(4-chloro-2-methyl-phenoxy)-N-[(5-chloro-2-pyridyl)carbamothioyl]acetamide
  • 2-(4-chloro-2-methylphenoxy)-N-[[(5-chloro-2-pyridyl)amino]-thioxomethyl]acetamide
  • 2-(4-chloro-2-methyl-phenoxy)-N-[(5-chloro-2-pyridyl)thiocarbamoyl]acetamide
  • 2-(4-chloro-2-methyl-phenoxy)-N-[(5-chloropyridin-2-yl)carbamothioyl]ethanamide
  • AN-465/40743516
  • ZINC00678425

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi FAD dependent oxidoreductase, putative 0.0042 0.0383 0.16
Brugia malayi eukaryotic initiation factor 4A 0.0052 0.0529 0.252
Echinococcus multilocularis L lactate dehydrogenase B chain 0.0048 0.0482 0.0428
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0161 0.2099 1
Entamoeba histolytica steroid 5-alpha reductase, putative 0.0161 0.2099 1
Echinococcus granulosus glycerol 3 phosphate dehydrogenase 0.0042 0.0383 0.0329
Plasmodium falciparum L-lactate dehydrogenase 0.0048 0.0482 0.9002
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0052 0.0529 0.0475
Schistosoma mansoni hypothetical protein 0.0175 0.2294 0.225
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0334 0.0279
Loa Loa (eye worm) hypothetical protein 0.0048 0.0482 0.0693
Echinococcus granulosus 3 oxo 5 alpha steroid 4 dehydrogenase C terminal 0.0023 0.0111 0.0055
Onchocerca volvulus Eukaryotic initiation factor 4A homolog 0.0052 0.0529 1
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0185 0.0267
Mycobacterium ulcerans glycerol-3-phosphate dehydrogenase 0.0042 0.0383 0.0474
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0042 0.0383 0.16
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0042 0.0383 0.16
Treponema pallidum ATP-dependent RNA helicase 0.0052 0.0529 0.5
Schistosoma mansoni hypothetical protein 0.0043 0.041 0.0356
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.041 0.0356
Plasmodium vivax FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0042 0.0383 0.6917
Loa Loa (eye worm) hypothetical protein 0.0042 0.0383 0.0551
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0052 0.0529 0.2313
Plasmodium falciparum polyprenol reductase, putative 0.0023 0.0111 0.1162
Schistosoma mansoni hypothetical protein 0.0175 0.2294 0.225
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0038 0.0334 0.0279
Mycobacterium leprae Possible thiamine biosynthesis oxidoreductase ThiO 0.0042 0.0383 0.0474
Echinococcus multilocularis 3 oxo 5 alpha steroid 4 dehydrogenase, C terminal 0.0023 0.0111 0.0055
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0035 0.0294 0.1162
Schistosoma mansoni L-lactate dehydrogenase 0.0048 0.0482 0.0428
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0334 0.0279
Trichomonas vaginalis rotamase, putative 0.0036 0.0306 0.1222
Echinococcus granulosus geminin 0.0175 0.2294 0.225
Mycobacterium tuberculosis Probable D-amino acid oxidase Aao 0.0457 0.6352 1
Echinococcus granulosus ubiquitin specific protease 41 0.0038 0.0334 0.0279
Loa Loa (eye worm) hypothetical protein 0.0042 0.0383 0.0551
Echinococcus granulosus eukaryotic initiation factor 4A III 0.0052 0.0529 0.0475
Giardia lamblia Glycerol-3-phosphate dehydrogenase 0.0042 0.0383 0.6917
Brugia malayi 3-oxo-5-alpha-steroid 4-dehydrogenase 1 0.0161 0.2099 1
Entamoeba histolytica DEAD/DEAH box helicase, putative 0.0052 0.0529 0.2313
Echinococcus multilocularis eukaryotic initiation factor 4A III 0.0052 0.0529 0.0475
Echinococcus multilocularis lamin dm0 0.0028 0.0185 0.0129
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0023 0.0111 0.0269
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0111 0.0269
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0038 0.0334 0.1589
Echinococcus granulosus lactate dehydrogenase a 0.0048 0.0482 0.0428
Schistosoma mansoni rotamase 0.0036 0.0306 0.0251
Plasmodium vivax 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0023 0.0111 0.1162
Leishmania major 3-oxo-5-alpha-steroid 4-dehydrogenase-like protein 0.0161 0.2099 1
Mycobacterium ulcerans D-amino acid oxidase Aao 0.0498 0.6949 1
Schistosoma mansoni malate dehydrogenase 0.0048 0.0482 0.0428
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0334 0.0279
Echinococcus granulosus FAD dependent oxidoreductase domain containing protein 0.0042 0.0383 0.0329
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0042 0.0383 0.16
Loa Loa (eye worm) malate dehydrogenase 0.0019 0.0057 0.0081
Toxoplasma gondii hypothetical protein 0.0042 0.0383 0.1368
Trypanosoma brucei L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0042 0.0383 0.16
Leishmania major glycerol-3-phosphate dehydrogenase-like protein 0.0042 0.0383 0.16
Echinococcus multilocularis musashi 0.0028 0.0185 0.0129
Echinococcus multilocularis geminin 0.0175 0.2294 0.225
Schistosoma mansoni lamin 0.0028 0.0185 0.0129
Toxoplasma gondii FAD-dependent glycerol-3-phosphate dehydrogenase 0.0042 0.0383 0.1368
Schistosoma mansoni microtubule-associated protein tau 0.0711 1 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0035 0.0294 0.1162
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0334 0.1356
Brugia malayi intermediate filament protein 0.0028 0.0185 0.0883
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.058 0.0526
Loa Loa (eye worm) hypothetical protein 0.0027 0.0178 0.0256
Loa Loa (eye worm) malate dehydrogenase 0.0019 0.0057 0.0081
Echinococcus multilocularis lactate dehydrogenase protein 0.0048 0.0482 0.0428
Giardia lamblia Translation initiation factor eIF-4A, putative 0.0052 0.0529 1
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0035 0.0294 0.1162
Schistosoma mansoni lamin 0.0028 0.0185 0.0129
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase-like, putative 0.0161 0.2099 1
Echinococcus multilocularis lactate dehydrogenase a 0.0048 0.0482 0.0428
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0334 0.1356
Onchocerca volvulus Dimethylglycine dehydrogenase, mitochondrial homolog 0.0042 0.0383 0.6511
Onchocerca volvulus Putative fad oxidoreductase 0.0042 0.0383 0.6511
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.058 0.0526
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0023 0.0111 0.0269
Trypanosoma brucei glycerol-3-phosphate dehydrogenase (FAD-dependent), mitochondrial 0.0042 0.0383 0.16
Brugia malayi cDNA sequence BC016226 0.0042 0.0383 0.1826
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0036 0.0306 0.0441
Entamoeba histolytica hypothetical protein 0.0043 0.041 0.1733
Echinococcus granulosus L lactate dehydrogenase 0.003 0.0211 0.0156
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0161 0.2099 1
Echinococcus multilocularis glycerol 3 phosphate dehydrogenase 0.0042 0.0383 0.0329
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0035 0.0294 0.1162
Echinococcus granulosus lactate dehydrogenase a 0.0048 0.0482 0.0428
Schistosoma mansoni intermediate filament proteins 0.0028 0.0185 0.0129
Brugia malayi lactate dehydrogenase. 0.0048 0.0482 0.2295
Entamoeba histolytica malate dehydrogenase, putative 0.0048 0.0482 0.2082
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0334 0.1356
Schistosoma mansoni fad oxidoreductase 0.0042 0.0383 0.0329
Mycobacterium leprae PROBABLE D-AMINO ACID OXIDASE AAO 0.0498 0.6949 1
Plasmodium vivax RNA helicase-1, putative 0.0052 0.0529 1
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0036 0.0306 0.1459
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0185 0.0883
Trichomonas vaginalis conserved hypothetical protein 0.0023 0.0111 0.0269
Loa Loa (eye worm) hypothetical protein 0.0023 0.0111 0.016
Echinococcus multilocularis FAD dependent oxidoreductase domain containing protein 0.0042 0.0383 0.0329
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0185 0.0267
Echinococcus multilocularis synaptic glycoprotein sc2 0.0023 0.0111 0.0055
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0023 0.0111 0.0269
Loa Loa (eye worm) hypothetical protein 0.0042 0.0383 0.0551
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0035 0.0294 0.1162
Onchocerca volvulus 0.0028 0.0185 0.177
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0023 0.0111 0.0269
Echinococcus granulosus eukaryotic initiation factor 4A 0.0052 0.0529 0.0475
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.058 0.0526
Brugia malayi Probable malate dehydrogenase, mitochondrial precursor 0.0019 0.0057 0.0269
Wolbachia endosymbiont of Brugia malayi malate dehydrogenase 0.0048 0.0482 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.058 0.0526
Onchocerca volvulus 0.0028 0.0185 0.177
Schistosoma mansoni glycerol-3-phosphate dehydrogenase 0.0042 0.0383 0.0329
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase, putative 0.0042 0.0383 0.16
Schistosoma mansoni NAD dehydrogenase 0.0042 0.0383 0.0329
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0161 0.2099 1
Echinococcus multilocularis lactate dehydrogenase a 0.0048 0.0482 0.0428
Echinococcus multilocularis lactate dehydrogenase a 0.0048 0.0482 0.0428
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0334 0.1356
Echinococcus multilocularis microtubule associated protein 2 0.0711 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.058 0.0526
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.058 0.0835
Echinococcus granulosus synaptic glycoprotein sc2 0.0023 0.0111 0.0055
Trichomonas vaginalis rotamase, putative 0.0035 0.0294 0.1162
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0161 0.2099 1
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0023 0.0111 0.0055
Entamoeba histolytica anaerobic glycerol-3-phosphate dehydrogenase subunit A, putative 0.0042 0.0383 0.16
Giardia lamblia Synaptic glycoprotein SC2 0.0023 0.0111 0.1162
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0161 0.2099 1
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0023 0.0111 0.0269
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0052 0.0529 0.0475
Leishmania major malate dehydrogenase, putative 0.0048 0.0482 0.2082
Brugia malayi Synaptic glycoprotein SC2 0.0023 0.0111 0.0531
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0334 0.1356
Echinococcus granulosus lactate dehydrogenase protein 0.0048 0.0482 0.0428
Mycobacterium ulcerans hypothetical protein 0.0161 0.2099 0.2963
Plasmodium falciparum FAD-dependent glycerol-3-phosphate dehydrogenase, putative 0.0042 0.0383 0.6917
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0019 0.0057 0.0269
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0038 0.0334 0.0279
Trypanosoma brucei Eukaryotic initiation factor 4A-1 0.0052 0.0529 0.2313
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0334 0.1356
Schistosoma mansoni ATP:guanidino kinase (Smc74) 0.0042 0.0383 0.0329
Trichomonas vaginalis conserved hypothetical protein 0.0036 0.0306 0.1222
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0052 0.0529 0.2313
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 20 0.0042 0.0383 0.16
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0052 0.0529 0.2313
Entamoeba histolytica hypothetical protein 0.0023 0.0111 0.0269
Leishmania major eukaryotic initiation factor 4a, putative 0.0052 0.0529 0.2313
Plasmodium vivax malate dehydrogenase, putative 0.0048 0.0482 0.9002
Trypanosoma cruzi L-2-hydroxyglutarate dehydrogenase, mitochondrial, putative 0.0042 0.0383 0.16
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0038 0.0334 0.1356
Mycobacterium leprae Probable cholesterol oxidase precursor ChoD (cholesterol-O2 oxidoreductase) 0.0042 0.0383 0.0474
Loa Loa (eye worm) hypothetical protein 0.0028 0.0185 0.0267
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.041 0.0356
Brugia malayi hypothetical protein 0.0043 0.041 0.1956
Onchocerca volvulus Pyruvate dehydrogenase phosphatase regulatory subunit, mitochondrial homolog 0.0042 0.0383 0.6511
Loa Loa (eye worm) glycerol-3-phosphate dehydrogenase 0.0042 0.0383 0.0551
Echinococcus granulosus lamin dm0 0.0028 0.0185 0.0129
Echinococcus multilocularis ubiquitin specific protease 41 0.0038 0.0334 0.0279
Loa Loa (eye worm) hypothetical protein 0.0052 0.0529 0.0761
Loa Loa (eye worm) hypothetical protein 0.0161 0.2099 0.302
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.058 0.0526
Entamoeba histolytica 3-oxo-5-alpha-steroid 4-dehydrogenase domain-containing protein 0.0023 0.0111 0.0269
Toxoplasma gondii lactate dehydrogenase LDH1 0.0048 0.0482 0.1863
Plasmodium falciparum 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0023 0.0111 0.1162
Entamoeba histolytica hypothetical protein 0.0043 0.041 0.1733
Echinococcus multilocularis eukaryotic initiation factor 4A 0.0052 0.0529 0.0475
Leishmania major hypothetical protein, conserved 0.0042 0.0383 0.16
Echinococcus multilocularis lamin 0.0028 0.0185 0.0129
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0042 0.0383 0.16
Toxoplasma gondii peptidylprolyl isomerase 0.0035 0.0294 0.0918
Entamoeba histolytica trans-2,3-enoyl-CoA reductase, putative 0.0023 0.0111 0.0269
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0052 0.0529 0.2313
Mycobacterium tuberculosis Possible thiamine biosynthesis oxidoreductase ThiO 0.0042 0.0383 0.0519
Trypanosoma brucei electron transfer flavoprotein-ubiquinone oxidoreductase, putative 0.0042 0.0383 0.16
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0038 0.0334 0.1356
Echinococcus granulosus expressed protein 0.0036 0.0306 0.0251
Plasmodium vivax lactate dehydrogenase 0.0048 0.0482 0.9002
Echinococcus multilocularis expressed protein 0.0036 0.0306 0.0251
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0023 0.0111 0.0055
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0038 0.0334 0.5864
Toxoplasma gondii eukaryotic initiation factor-4A, putative 0.0052 0.0529 0.21
Brugia malayi pyruvate dehydrogenase phosphatase regulatory subunit precursor 0.0042 0.0383 0.1826
Plasmodium vivax polyprenol reductase, putative 0.0023 0.0111 0.1162
Echinococcus granulosus lamin 0.0028 0.0185 0.0129
Loa Loa (eye worm) hypothetical protein 0.0038 0.0334 0.048
Mycobacterium tuberculosis Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog) 0.0052 0.0529 0.075
Entamoeba histolytica hypothetical protein 0.0043 0.041 0.1733
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.058 0.0526
Brugia malayi RE18450p 0.0042 0.0383 0.1826
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0334 0.0279
Mycobacterium ulcerans glycerol-3-phosphate dehydrogenase GlpD2 0.0042 0.0383 0.0474
Echinococcus granulosus L lactate dehydrogenase B chain 0.0048 0.0482 0.0428
Leishmania major hypothetical protein, conserved 0.0042 0.0383 0.16
Mycobacterium ulcerans thiamine biosynthesis oxidoreductase ThiO 0.0042 0.0383 0.0474
Loa Loa (eye worm) hypothetical protein 0.0498 0.6949 1
Entamoeba histolytica hypothetical protein 0.0043 0.041 0.1733
Chlamydia trachomatis D-amino acid dehydrogenase 0.0042 0.0383 1
Mycobacterium ulcerans D-amino acid oxidase Aao 0.0042 0.0383 0.0474
Schistosoma mansoni fad oxidoreductase 0.0042 0.0383 0.0329
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0161 0.2099 1
Schistosoma mansoni d-amino acid oxidase 0.0498 0.6949 0.6932
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0052 0.0529 0.2313
Toxoplasma gondii lactate dehydrogenase LDH2 0.0048 0.0482 0.1863
Echinococcus granulosus intermediate filament protein 0.0028 0.0185 0.0129
Trypanosoma cruzi glycerol-3-phosphate dehydrogenase (FAD-dependent), putative 0.0042 0.0383 0.16
Echinococcus multilocularis L lactate dehydrogenase 0.003 0.0211 0.0156
Plasmodium falciparum eukaryotic initiation factor 4A 0.0052 0.0529 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0111 0.016
Trichomonas vaginalis synaptic glycoprotein sc2, putative 0.0023 0.0111 0.0269
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.058 0.2763
Brugia malayi dimethylglycine dehydrogenase, mitochondrial precursor, putative 0.0042 0.0383 0.1826
Toxoplasma gondii malate dehydrogenase MDH 0.0048 0.0482 0.1863
Trypanosoma brucei FAD dependent oxidoreductase, putative 0.0042 0.0383 0.16
Leishmania major eukaryotic initiation factor 4a, putative 0.0052 0.0529 0.2313
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.041 0.0356
Plasmodium falciparum malate dehydrogenase 0.0048 0.0482 0.9002

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 5.0119 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 5.6234 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 6.5131 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 16.5113 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) 32.6294 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) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Fluorescence Polarization Assay for Inhibitors of MLL CXXC domain - DNA interaction. (Class of assay: confirmatory) [Related pubchem assays: 2698 (Summary assay.)] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
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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