Detailed information for compound 1540887

Basic information

Technical information
  • TDR Targets ID: 1540887
  • Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitroimidaz ol-1-yl)ethanone
  • MW: 275.26 | Formula: C13H13N3O4
  • H donors: 0 H acceptors: 4 LogP: 2.06 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)C(=O)Cn1cc(nc1C)[N+](=O)[O-]
  • InChi: 1S/C13H13N3O4/c1-9-14-13(16(18)19)8-15(9)7-12(17)10-3-5-11(20-2)6-4-10/h3-6,8H,7H2,1-2H3
  • InChiKey: NHGFSXWTQKKMFZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone
  • 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-1-imidazolyl)ethanone
  • Maybridge1_006727
  • ZINC00084202
  • Oprea1_563862

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens glycoprotein hormones, alpha polypeptide Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi RNA recognition motif domain containing 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
Schistosoma mansoni tar DNA-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
Schistosoma japonicum TAR DNA-binding protein 43, putative 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
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing 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
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma japonicum TAR DNA-binding protein 43, putative 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
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
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0039 0.0491 0.0491
Leishmania major cytochrome p450-like protein 0.0092 0.1241 0.4526
Echinococcus multilocularis neutral sphingomyelinase 0.0039 0.0491 0.08
Schistosoma mansoni ap endonuclease 0.0194 0.2705 0.4409
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Echinococcus multilocularis succinate semialdehyde dehydrogenase 0.0007 0.0031 0.0051
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0092 0.1241 0.4526
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0092 0.1241 0.4526
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0092 0.1241 0.4526
Toxoplasma gondii cytochrome p450 superfamily protein 0.0092 0.1241 0.4526
Brugia malayi Cytochrome P450 family protein 0.0183 0.2539 0.2539
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0092 0.1241 0.4526
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0127 0.175 0.6429
Schistosoma mansoni aldehyde dehydrogenase 0.0007 0.0031 0.0051
Echinococcus granulosus aldehyde dehydrogenase family 3 member B1 0.0007 0.0031 0.0051
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0039 0.0064
Loa Loa (eye worm) hypothetical protein 0.0007 0.0031 0.0031
Onchocerca volvulus 0.003 0.0367 0.7467
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0194 0.2705 0.2705
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0092 0.1241 0.4526
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.0756 0.2712
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0039 0.0491 0.1724
Brugia malayi RNA binding protein 0.0076 0.1024 0.1024
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0092 0.1241 0.4526
Loa Loa (eye worm) cytochrome P450 family protein 0.0183 0.2539 0.2539
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0092 0.1241 0.4526
Leishmania major hypothetical protein, conserved 0.0039 0.0491 0.172
Schistosoma mansoni cpg binding protein 0.003 0.0367 0.0598
Echinococcus granulosus betaine aldehyde dehydrogenase 0.0007 0.0031 0.0051
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.1024 0.1024
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0066 0.0107
Schistosoma mansoni aldehyde dehydrogenase 0.0007 0.0031 0.0051
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0705 1 1
Schistosoma mansoni cpg binding protein 0.0032 0.0392 0.0638
Loa Loa (eye worm) hypothetical protein 0.0039 0.0491 0.0491
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0092 0.1241 0.4526
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0127 0.175 0.2853
Schistosoma mansoni cpg binding protein 0.0032 0.0392 0.0638
Entamoeba histolytica inositol polyphosphate 5-phosphatase, putative 0.0039 0.0491 0.172
Trypanosoma brucei RNA editing exonuclease 2 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0092 0.1241 0.4526
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Schistosoma mansoni ocrl type II inositol 5-phosphatase 0.0039 0.0491 0.08
Loa Loa (eye worm) hypothetical protein 0.0039 0.0491 0.0491
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0039 0.0064
Toxoplasma gondii exonuclease III APE 0.0194 0.2705 1
Echinococcus granulosus cpg binding protein 0.0032 0.0392 0.0638
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0039 0.0491 0.172
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0092 0.1241 0.4526
Trichomonas vaginalis type II inositol 5-phosphatase, putative 0.0039 0.0491 0.1724
Trypanosoma cruzi mitochondrial protein 99, putative 0.0039 0.0491 0.172
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.175 0.6429
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0039 0.0491 0.08
Schistosoma mansoni hypothetical protein 0.0039 0.0491 0.08
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1024 0.1669
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0183 0.2539 0.9378
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0092 0.1241 0.4526
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Schistosoma mansoni aldehyde dehydrogenase 0.0007 0.0031 0.0051
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0039 0.0491 0.0491
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0092 0.1241 0.4526
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0194 0.2705 1
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0092 0.1241 0.4526
Echinococcus multilocularis traf and tnf receptor associated protein 0.0039 0.0491 0.08
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0066 0.0066
Mycobacterium tuberculosis Probable exported protein 0.0039 0.0491 0.172
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0092 0.1241 0.4526
Echinococcus multilocularis CCR4 NOT transcription complex subunit 6 0.0039 0.0491 0.08
Echinococcus granulosus traf and tnf receptor associated protein 0.0039 0.0491 0.08
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0194 0.2705 1
Echinococcus granulosus cytochrome P450 2K1 0.0092 0.1241 0.2023
Echinococcus granulosus CCR4 NOT transcription complex subunit 6 0.0039 0.0491 0.08
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0194 0.2705 1
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0092 0.1241 0.4526
Loa Loa (eye worm) CYP4Cod1 0.0183 0.2539 0.2539
Leishmania major inositol phosphosphingolipid phospholipase C-Like 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0092 0.1241 0.4526
Leishmania major RNA-editing complex protein MP100, putative 0.0039 0.0491 0.172
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0092 0.1241 0.4526
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0039 0.0491 0.172
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.175 0.6429
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0039 0.0064
Loa Loa (eye worm) CCR4-NOT transcription complex subunit 6 family protein 0.0039 0.0491 0.0491
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Trypanosoma cruzi cytochrome P450, putative 0.0183 0.2539 0.9378
Loa Loa (eye worm) aldehyde dehydrogenase 4 0.0007 0.0031 0.0031
Trypanosoma brucei inositol-1,4,5-trisphosphate (IP3) 5-phosphatase, putative 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0092 0.1241 0.4526
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0092 0.1241 0.4526
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0092 0.1241 0.4526
Echinococcus granulosus neutral sphingomyelinase 0.0039 0.0491 0.08
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0092 0.1241 0.4526
Brugia malayi aldehyde dehydrogenase 0.0007 0.0031 0.0031
Schistosoma mansoni hypothetical protein 0.0092 0.1241 0.2023
Echinococcus multilocularis synaptojanin 1 0.0039 0.0491 0.08
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0092 0.1241 0.4526
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0039 0.0491 0.0491
Loa Loa (eye worm) delta-1-pyrroline-5-carboxylate dehydrogenase 0.0007 0.0031 0.0031
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.1024 0.1024
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0092 0.1241 0.4526
Trichomonas vaginalis type IV inositol 5-phosphatase, putative 0.0039 0.0491 0.1724
Trichomonas vaginalis succinate semialdehyde dehydrogenase, putative 0.0007 0.0031 0.0005
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0194 0.2705 1
Brugia malayi Cytochrome P450 family protein 0.0368 0.519 0.519
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Loa Loa (eye worm) aldehyde dehydrogenase 0.0007 0.0031 0.0031
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Brugia malayi Succinate semialdehyde dehydrogenase, mitochondrial precursor 0.0007 0.0031 0.0031
Brugia malayi Aldehyde dehydrogenase protein 4 0.0007 0.0031 0.0031
Schistosoma mansoni hypothetical protein 0.0007 0.0031 0.0051
Echinococcus multilocularis Fatty aldehyde dehydrogenase 0.0007 0.0031 0.0051
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Schistosoma mansoni aldehyde dehydrogenase 0.0127 0.175 0.2853
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0092 0.1241 0.4526
Toxoplasma gondii aldehyde dehydrogenase 0.0127 0.175 0.6429
Trypanosoma cruzi mitochondrial protein 99, putative 0.0039 0.0491 0.172
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0064 0.0064
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0092 0.1241 0.4526
Leishmania major hypothetical protein, conserved 0.0039 0.0491 0.172
Echinococcus granulosus succinate semialdehyde dehydrogenase 0.0007 0.0031 0.0051
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0092 0.1241 0.4526
Leishmania major inositol/phosphatidylinositol phosphatase, putative 0.0039 0.0491 0.172
Brugia malayi Cytochrome P450 family protein 0.0183 0.2539 0.2539
Trichomonas vaginalis ap endonuclease, putative 0.0194 0.2705 1
Trichomonas vaginalis ocrl type II inositol 5-phosphatase, putative 0.0039 0.0491 0.1724
Leishmania major cytochrome p450-like protein 0.0183 0.2539 0.9378
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0039 0.0064
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0194 0.2705 0.4409
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0092 0.1241 0.4526
Schistosoma mansoni cytochrome P450 0.0092 0.1241 0.2023
Loa Loa (eye worm) hypothetical protein 0.0091 0.1228 0.1228
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Mycobacterium leprae Conserved hypothetical protein 0.0092 0.1241 1
Trypanosoma brucei Inositol phosphosphingolipids phospholipase C 0.0039 0.0491 0.172
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0066 0.0107
Loa Loa (eye worm) RNA binding protein 0.0076 0.1024 0.1024
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1024 0.1669
Loa Loa (eye worm) TAR-binding protein 0.0076 0.1024 0.1024
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Treponema pallidum hypothetical protein 0.0039 0.0491 0.172
Trypanosoma brucei DNA-(apurinic or apyrimidinic site) lyase, putative 0.0039 0.0491 0.172
Trichomonas vaginalis sphingomyelinase C 2 precursor, putative 0.0039 0.0491 0.1724
Onchocerca volvulus Aldehyde dehydrogenase homolog 0.0007 0.0031 0.0635
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0194 0.2705 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0194 0.2705 1
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Echinococcus granulosus synaptojanin 1 0.0039 0.0491 0.08
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0092 0.1241 0.4526
Loa Loa (eye worm) cytochrome P450 family protein 0.0368 0.519 0.519
Leishmania major hypothetical protein, conserved 0.0039 0.0491 0.172
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1024 0.1669
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Brugia malayi CXXC zinc finger family protein 0.003 0.0367 0.0367
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0092 0.1241 0.4526
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0367 0.0367
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.175 0.6429
Onchocerca volvulus Putative neutral sphingomyelinase 0.0039 0.0491 1
Echinococcus multilocularis succinate semialdehyde dehydrogenase 0.0007 0.0031 0.0051
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0039 0.0491 0.08
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0039 0.0064
Leishmania major cytochrome p450-like protein 0.0092 0.1241 0.4526
Echinococcus multilocularis deoxyribonuclease 1 2 0.0039 0.0491 0.08
Trypanosoma cruzi cytochrome P450, putative 0.0183 0.2539 0.9378
Schistosoma mansoni aldehyde dehydrogenase 0.0007 0.0031 0.0051
Schistosoma mansoni carbon catabolite repressor protein 0.0039 0.0491 0.08
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0092 0.1241 0.4526
Leishmania major pantothenate kinase subunit, putative 0.0039 0.0491 0.172
Trypanosoma cruzi inositol 5-phosphatase 1, putative 0.0039 0.0491 0.172
Echinococcus multilocularis dnaJ subfamily B 0.0434 0.6135 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0065 0.0855 0.1394
Echinococcus multilocularis 0.0092 0.1241 0.2023
Schistosoma mansoni synaptojanin 0.0039 0.0491 0.08
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0092 0.1241 0.4526
Schistosoma mansoni ap endonuclease 0.0194 0.2705 0.4409
Trichomonas vaginalis ap endonuclease, putative 0.0194 0.2705 1
Loa Loa (eye worm) hypothetical protein 0.0007 0.0031 0.0031
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0092 0.1241 0.4526
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0092 0.1241 0.4526
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1024 0.1669
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0039 0.0491 0.1724
Schistosoma mansoni cript-related 0.0039 0.0491 0.08
Echinococcus granulosus inositol polyphosphate 5 phosphatase OCRL 1 0.0039 0.0491 0.08
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0194 0.2705 1
Schistosoma mansoni neutral sphingomyelinase 0.0039 0.0491 0.08
Brugia malayi exodeoxyribonuclease III family protein 0.0194 0.2705 0.2705
Schistosoma mansoni hypothetical protein 0.0434 0.6135 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1024 0.1669
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0092 0.1241 0.4526
Treponema pallidum exodeoxyribonuclease (exoA) 0.0194 0.2705 1
Echinococcus granulosus Fatty aldehyde dehydrogenase 0.0007 0.0031 0.0051
Leishmania major endonuclease/exonuclease protein-like protein 0.0039 0.0491 0.172
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0039 0.0491 0.1724
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0039 0.0491 0.172
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Entamoeba histolytica sphingomyelinase C precursor, putative 0.0039 0.0491 0.172
Giardia lamblia hypothetical protein 0.0039 0.0491 0.172
Brugia malayi cytochrome P450 0.0092 0.1241 0.1241
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0092 0.1241 0.4526
Trypanosoma brucei inositol/phosphatidylinositol phosphatase, putative 0.0039 0.0491 0.172
Echinococcus granulosus dnaJ subfamily B 0.0434 0.6135 1
Echinococcus multilocularis cpg binding protein 0.0032 0.0392 0.0638
Entamoeba histolytica inositol polyphosphate-5-phosphatase, putative 0.0039 0.0491 0.172
Trypanosoma brucei Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Trichomonas vaginalis Phospholipase C precursor, putative 0.0039 0.0491 0.1724
Trypanosoma brucei cytochrome P450, putative 0.0183 0.2539 0.9378
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Loa Loa (eye worm) cytochrome P450 family protein 0.0183 0.2539 0.2539
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0194 0.2705 1
Trypanosoma cruzi pantothenate kinase subunit, putative 0.0039 0.0491 0.172
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0092 0.1241 0.4526
Loa Loa (eye worm) hypothetical protein 0.0039 0.0491 0.0491
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0092 0.1241 0.4526
Schistosoma mansoni synaptojanin 0.0039 0.0491 0.08
Onchocerca volvulus 0.0039 0.0491 1
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0092 0.1241 0.4526
Trypanosoma cruzi endonuclease/exonuclease/phosphatase, putative 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0092 0.1241 0.4526
Mycobacterium leprae putative cytochrome p450 0.0092 0.1241 1
Schistosoma mansoni aldehyde dehydrogenase 0.0127 0.175 0.2853
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0039 0.0491 0.0491
Brugia malayi Cytochrome P450 family protein 0.0092 0.1241 0.1241
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0194 0.2705 1
Loa Loa (eye worm) cytochrome P450 0.0092 0.1241 0.1241
Loa Loa (eye worm) hypothetical protein 0.0039 0.0491 0.0491
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Schistosoma mansoni delta 1-pyrroline-5-carboxylate synthetase 0.0007 0.0031 0.0051
Schistosoma mansoni succinate semialdehyde dehydrogenase 0.0007 0.0031 0.0051
Giardia lamblia Inositol 5-phosphatase 4 0.0039 0.0491 0.172
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0092 0.1241 0.4526
Echinococcus multilocularis tar DNA binding protein 0.0076 0.1024 0.1669
Echinococcus granulosus tar DNA binding protein 0.0076 0.1024 0.1669
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Echinococcus multilocularis aldehyde dehydrogenase family 3 member B1 0.0007 0.0031 0.0051
Echinococcus multilocularis inositol polyphosphate 5 phosphatase OCRL 1 0.0039 0.0491 0.08
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0127 0.175 0.6429
Schistosoma mansoni nocturnin 0.0039 0.0491 0.08
Trichomonas vaginalis skeletal muscle/kidney enriched inositol 5-phosphatase, putative 0.0039 0.0491 0.1724
Brugia malayi CCR4 0.0039 0.0491 0.0491
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0092 0.1241 0.4526
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0194 0.2705 1
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0092 0.1241 0.4526
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0092 0.1241 0.4526
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0039 0.0491 0.0491
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0039 0.0491 0.172
Onchocerca volvulus 0.0039 0.0491 1
Echinococcus multilocularis betaine aldehyde dehydrogenase 0.0007 0.0031 0.0051
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0039 0.0491 0.0491
Brugia malayi TAR-binding protein 0.0076 0.1024 0.1024
Trypanosoma cruzi RNA-editing complex protein MP100, putative 0.0039 0.0491 0.172
Trypanosoma cruzi Endonuclease/Exonuclease/phosphatase family, putative 0.0039 0.0491 0.172
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0092 0.1241 0.4526
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0194 0.2705 1
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0092 0.1241 0.4526
Trypanosoma cruzi Inositol phosphosphingolipids phospholipase C 0.0039 0.0491 0.172
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0127 0.175 0.2853
Brugia malayi Delta-1-pyrroline-5-carboxylate dehydrogenase, mitochondrial precursor 0.0007 0.0031 0.0031
Schistosoma mansoni aldehyde dehydrogenase 0.0007 0.0031 0.0051
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0194 0.2705 0.4409

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.7783 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No 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) 6.5733 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) 35.4813 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) 35.4813 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

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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