Detailed information for compound 209657

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 250.251 | Formula: C12H14N2O4
  • H donors: 2 H acceptors: 2 LogP: 0.01 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc2C=C(CN(C(=O)N)O)COc2cc1
  • InChi: 1S/C12H14N2O4/c1-17-10-2-3-11-9(5-10)4-8(7-18-11)6-14(16)12(13)15/h2-5,16H,6-7H2,1H3,(H2,13,15)
  • InChiKey: RQCRACKRJFXMBX-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 arachidonate 5-lipoxygenase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus arachidonate 5 lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma japonicum IPR001024,Lipoxygenase, LH2;IPR013819,Lipoxygenase, C-terminal,domain-containing Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma japonicum ko:K00461 arachidonate 5-lipoxygenase [EC1.13.11.34], putative Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma mansoni lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma mansoni lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Echinococcus multilocularis arachidonate 5 lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
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
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Brugia malayi hypothetical protein 0.0024 0.0087 0.0465
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0059 0.0184
Giardia lamblia Reverse transcriptase/endonuclease 0.0024 0.0092 0.0136
Trichomonas vaginalis phosphofructokinase, putative 0.0116 0.0776 0.1995
Schistosoma mansoni hypothetical protein 0.0349 0.2517 0.2487
Brugia malayi Thioredoxin reductase 0.005 0.0286 0.1592
Toxoplasma gondii thioredoxin reductase 0.005 0.0286 0.1507
Echinococcus granulosus RNA directed DNA polymerase reverse transcriptase 0.0024 0.0092 0.0317
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0115 0.0769 0.8837
Trichomonas vaginalis NeSL-1_NeSL reverse transcriptases, putative 0.0024 0.0092 0.0237
Toxoplasma gondii 6-phosphofructokinase 0.0031 0.0143 0.0689
Echinococcus multilocularis 6 phosphofructokinase 0.0116 0.0776 0.3047
Toxoplasma gondii ribonuclease HI protein 0.0249 0.1771 1
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.004 0.005
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0017 0.004 0.0097
Trypanosoma cruzi hypothetical protein, conserved 0.0024 0.0092 0.0237
Trypanosoma brucei Endonuclease-reverse transcriptase/Reverse transcriptase (RNA-dependent DNA polymerase), putative 0.0024 0.0092 0.0115
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0143 0.2335
Loa Loa (eye worm) hypothetical protein 0.0024 0.0087 0.0445
Trypanosoma brucei retrotransposon hot spot protein 4 (RHS4), interrupted 0.0273 0.1954 0.2445
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0115 0.0769 0.8837
Onchocerca volvulus 0.0024 0.0092 0.0029
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.004 0.0102
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0059 0.0285
Mycobacterium tuberculosis Probable dehydrogenase 0.0115 0.0769 0.8837
Schistosoma mansoni lipoxygenase 0.01 0.0654 0.0617
Entamoeba histolytica phosphofructokinase, putative 0.0116 0.0776 0.1995
Schistosoma mansoni thymidylate kinase 0.0077 0.0483 0.0445
Brugia malayi RNase H family protein 0.0249 0.1771 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0128 0.0865 1
Entamoeba histolytica phosphofructokinase, putative 0.0116 0.0776 0.1995
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0059 0.005
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0059 0.0234
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Schistosoma mansoni rab6-interacting 0.0024 0.0087 0.0048
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0116 0.0776 0.8918
Trichomonas vaginalis reverse transcriptases, putative 0.0024 0.0092 0.0237
Echinococcus granulosus KRAB A domain containing protein 0.0024 0.0092 0.0317
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0142 0.0975 0.3841
Loa Loa (eye worm) hypothetical protein 0.0029 0.0124 0.0655
Echinococcus multilocularis thioredoxin glutathione reductase 0.005 0.0286 0.1092
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Brugia malayi follicle stimulating hormone receptor 0.0249 0.1769 0.9989
Trichomonas vaginalis glutathione reductase, putative 0.0017 0.004 0.0102
Onchocerca volvulus Telomerase reverse transcriptase homolog 0.0024 0.0092 0.0029
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0116 0.0776 0.4253
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0079 0.0265
Trichomonas vaginalis mercuric reductase, putative 0.0017 0.004 0.0102
Echinococcus granulosus lamin dm0 0.0029 0.0124 0.0444
Leishmania major thymidylate kinase-like protein 0.0077 0.0483 0.1242
Trichomonas vaginalis ribonuclease H1, putative 0.0249 0.1771 0.4552
Brugia malayi thymidylate kinase 0.0077 0.0483 0.2707
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Brugia malayi hypothetical protein 0.0024 0.0092 0.0493
Brugia malayi Zinc knuckle family protein 0.0024 0.0092 0.0493
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0059 0.0184
Brugia malayi reverse transcriptase 0.0024 0.0092 0.0493
Brugia malayi glutathione reductase 0.005 0.0286 0.1592
Schistosoma mansoni hypothetical protein 0.108 0.7992 0.7984
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0059 0.0152
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0031 0.0143 0.0689
Loa Loa (eye worm) 6-phosphofructokinase 0.0116 0.0776 0.4358
Echinococcus multilocularis ribonuclease H1 0.0249 0.1771 0.702
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0017 0.004 0.0102
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0087 0.0297
Treponema pallidum thymidylate kinase (tmk) 0.0077 0.0483 0.2561
Loa Loa (eye worm) doublecortin family protein 0.0024 0.0087 0.0445
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0143 0.2335
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.004 0.0107
Echinococcus multilocularis musashi 0.0029 0.0124 0.0444
Brugia malayi hypothetical protein 0.0024 0.0092 0.0493
Trypanosoma brucei ingi protein (ORF1) 0.0273 0.1954 0.2445
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Echinococcus granulosus RNA directed DNA polymerase reverse transcriptase 0.0024 0.0092 0.0317
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0116 0.0776 0.1995
Echinococcus granulosus lamin 0.0029 0.0124 0.0444
Plasmodium falciparum thymidylate kinase 0.0077 0.0483 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0059 0.0074
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0249 0.1769 1
Schistosoma mansoni hypothetical protein 0.0077 0.0483 0.0445
Trypanosoma cruzi trypanothione reductase, putative 0.0017 0.004 0.0102
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0017 0.004 0.034
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Mycobacterium tuberculosis Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK) 0.0077 0.0483 0.5371
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0059 0.0112
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0116 0.0776 0.0971
Trichomonas vaginalis thymidylate kinase, putative 0.0077 0.0483 0.1242
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Echinococcus granulosus intermediate filament protein 0.0029 0.0124 0.0444
Trichomonas vaginalis phosphofructokinase, putative 0.0116 0.0776 0.1995
Trypanosoma cruzi trypanothione reductase, putative 0.005 0.0286 0.0736
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0059 0.0152
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0059 0.0761
Plasmodium vivax multidomain scavenger receptor, putative 0.0024 0.0087 0.1374
Echinococcus granulosus geminin 0.0349 0.2517 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0115 0.0769 0.8837
Schistosoma mansoni intermediate filament proteins 0.0029 0.0124 0.0085
Trypanosoma cruzi thymidine kinase, putative 0.0532 0.3891 1
Echinococcus multilocularis RUN 0.0024 0.0087 0.0297
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Loa Loa (eye worm) 6-phosphofructokinase 0.0116 0.0776 0.4358
Trypanosoma cruzi ribonuclease H1, putative 0.0249 0.1771 0.4552
Trichomonas vaginalis reverse transcriptases, putative 0.0024 0.0092 0.0237
Schistosoma mansoni phosphoglucomutase 0.0249 0.1771 0.1738
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0115 0.0769 0.7488
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.004 0.0102
Trypanosoma brucei SLACS retrotransposable element (part), putative 0.0024 0.0092 0.0115
Giardia lamblia CDC8 0.0077 0.0483 0.1151
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Echinococcus granulosus 6 phosphofructokinase 0.0116 0.0776 0.3047
Giardia lamblia Reverse transcriptase/endonuclease, putative 0.0024 0.0092 0.0136
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.004 0.005
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0128 0.0865 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0013 0.0022
Giardia lamblia Reverse transcriptase/endonuclease, putative 0.0024 0.0092 0.0136
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0079 0.042
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0024 0.0087
Brugia malayi reverse transcriptase 0.0024 0.0092 0.0493
Trichomonas vaginalis phosphofructokinase, putative 0.0116 0.0776 0.1995
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0017 0.004 0.034
Echinococcus granulosus thymidylate kinase 0.0077 0.0483 0.1878
Brugia malayi Doublecortin family protein 0.0024 0.0087 0.0465
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.004 0.0107
Wolbachia endosymbiont of Brugia malayi ribonuclease HI 0.0249 0.1771 1
Trypanosoma brucei hypothetical protein, conserved 0.0273 0.1954 0.2445
Schistosoma mansoni scy1(yeast) protein kinase-like 0.0024 0.0092 0.0053
Schistosoma mansoni phosphoglucomutase 0.0249 0.1771 0.1738
Brugia malayi hypothetical protein 0.0024 0.0087 0.0465
Trypanosoma brucei thymidylate kinase, putative 0.0077 0.0483 0.0605
Trypanosoma brucei thymidine kinase 0.0532 0.3891 0.4868
Trypanosoma cruzi thymidylate kinase, putative 0.0077 0.0483 0.1242
Leishmania major ATP-dependent phosphofructokinase 0.0116 0.0776 0.1995
Leishmania major thymidine kinase, putative 0.0532 0.3891 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0059 0.0152
Echinococcus granulosus RNA directed DNA polymerase reverse transcriptase 0.0024 0.0092 0.0317
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0059 0.0262
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.003 0.0134 0.0345
Loa Loa (eye worm) RecQ helicase 0.0023 0.0079 0.04
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0059 0.0436
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Toxoplasma gondii exonuclease III APE 0.002 0.0059 0.0208
Brugia malayi intermediate filament protein 0.0029 0.0124 0.0674
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.004 0.0196
Schistosoma mansoni lipoxygenase 0.0142 0.0975 0.0939
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0143 0.2596
Onchocerca volvulus Putative thymidylate kinase 0.0077 0.0483 0.2352
Echinococcus granulosus ribonuclease H1 0.0249 0.1771 0.702
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0031 0.0143 0.0598
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Trichomonas vaginalis thymidine kinase, putative 0.0532 0.3891 1
Schistosoma mansoni polycystin 1-related 0.0024 0.0087 0.0048
Brugia malayi hypothetical protein 0.0024 0.0092 0.0493
Loa Loa (eye worm) thioredoxin reductase 0.005 0.0286 0.1575
Mycobacterium ulcerans thymidylate kinase 0.0077 0.0483 0.6022
Giardia lamblia Reverse transcriptase/endonuclease, putative 0.0024 0.0092 0.0136
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Loa Loa (eye worm) hypothetical protein 0.0018 0.0045 0.0204
Mycobacterium tuberculosis Probable oxidoreductase 0.0128 0.0865 1
Schistosoma mansoni hypothetical protein 0.0024 0.0087 0.0048
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0059 0.0152
Onchocerca volvulus 0.0029 0.0124 0.0219
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Onchocerca volvulus 0.0029 0.0124 0.0219
Plasmodium vivax thymidylate kinase, putative 0.0077 0.0483 1
Schistosoma mansoni phosphoglucomutase 0.0249 0.1771 0.1738
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0079 0.0204
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0024 0.0092 0.0317
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.004 0.0102
Brugia malayi Intermediate filament tail domain containing protein 0.0029 0.0124 0.0674
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0116 0.0776 0.7663
Echinococcus granulosus Polycystic kidney disease protein 0.0024 0.0087 0.0297
Plasmodium vivax thioredoxin reductase, putative 0.005 0.0286 0.5709
Leishmania major trypanothione reductase 0.005 0.0286 0.0736
Trypanosoma brucei trypanothione reductase 0.005 0.0286 0.0358
Loa Loa (eye worm) hypothetical protein 0.0028 0.012 0.0632
Mycobacterium tuberculosis Possible maturase 0.0024 0.0092 0.0635
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0143 0.2335
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0087 0.0297
Schistosoma mansoni protein kinase 0.0024 0.0092 0.0053
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0059 0.0306
Trichomonas vaginalis thymidine kinase, putative 0.0532 0.3891 1
Trypanosoma brucei unspecified product 0.0273 0.1954 0.2445
Entamoeba histolytica phosphofructokinase, putative 0.0116 0.0776 0.1995
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0087 0.0297
Schistosoma mansoni serine/threonine protein kinase 0.0024 0.0092 0.0053
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0029 0.0124 0.0655
Plasmodium falciparum LCCL domain-containing protein 0.0024 0.0087 0.107
Echinococcus granulosus RUN 0.0024 0.0087 0.0297
Schistosoma mansoni hypothetical protein 0.0024 0.0092 0.0053
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0087 0.0297
Echinococcus multilocularis geminin 0.0349 0.2517 1
Treponema pallidum ribonuclease H (rnhA) 0.0249 0.1771 1
Plasmodium vivax glutathione reductase, putative 0.005 0.0286 0.5709
Toxoplasma gondii thymidylate kinase 0.0077 0.0483 0.2634
Trypanosoma brucei RNA helicase, putative 0.108 0.7992 1
Brugia malayi hypothetical protein 0.0024 0.0092 0.0493
Schistosoma mansoni ap endonuclease 0.002 0.0059 0.0019
Brugia malayi RNase H family protein 0.0249 0.1771 1
Schistosoma mansoni hypothetical protein 0.0024 0.0092 0.0053
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0143 0.2335
Echinococcus granulosus RNA directed DNA polymerase 0.0024 0.0092 0.0317
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.003 0.0134 0.0345
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Chlamydia trachomatis thymidylate kinase 0.0077 0.0483 1
Trichomonas vaginalis thymidylate kinase, putative 0.0077 0.0483 0.1242
Brugia malayi Zinc knuckle family protein 0.0024 0.0092 0.0493
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0031 0.0143 0.0368
Loa Loa (eye worm) glutathione reductase 0.005 0.0286 0.1575
Trypanosoma cruzi thymidine kinase, putative 0.0532 0.3891 1
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Schistosoma mansoni thymidylate kinase 0.0077 0.0483 0.0445
Trypanosoma brucei thymidylate kinase, putative 0.0077 0.0483 0.0605
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0059 0.0152
Entamoeba histolytica thymidine kinase, putative 0.0532 0.3891 1
Schistosoma mansoni hypothetical protein 0.0349 0.2517 0.2487
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Mycobacterium ulcerans 6-phosphofructokinase 0.0116 0.0776 1
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0024 0.0109
Schistosoma mansoni 6-phosphofructokinase 0.0116 0.0776 0.0739
Plasmodium falciparum glutathione reductase 0.005 0.0286 0.5558
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0128 0.0865 1
Entamoeba histolytica Thymidylate kinase, putative 0.0077 0.0483 0.1242
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0245 0.1744 0.1711
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Loa Loa (eye worm) thymidylate kinase 0.0077 0.0483 0.2694
Giardia lamblia Ribonuclease H 0.0249 0.1771 0.4496
Trichomonas vaginalis phosphofructokinase, putative 0.0116 0.0776 0.1995
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.004 0.005
Leishmania major hypothetical protein, conserved 0.003 0.0134 0.0345
Echinococcus multilocularis Polycystic kidney disease protein 0.0024 0.0087 0.0297
Toxoplasma gondii NADPH-glutathione reductase 0.0017 0.004 0.0097
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0059 0.0112
Schistosoma mansoni blooms syndrome DNA helicase 0.0018 0.0043 0.0004
Echinococcus granulosus bloom syndrome protein 0.0023 0.0079 0.0265
Schistosoma mansoni lamin 0.0029 0.0124 0.0085
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0115 0.0769 0.8837
Trichomonas vaginalis thymidine kinase, putative 0.0532 0.3891 1
Giardia lamblia Reverse transcriptase/endonuclease, putative 0.0024 0.0092 0.0136
Onchocerca volvulus 0.0024 0.0092 0.0029
Schistosoma mansoni lamin 0.0029 0.0124 0.0085
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Onchocerca volvulus Ribonuclease H1 homolog 0.0249 0.1771 1
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0017 0.004 0.0102
Loa Loa (eye worm) hypothetical protein 0.0024 0.0087 0.0445
Giardia lamblia Thymidine kinase 0.0532 0.3891 1
Loa Loa (eye worm) intermediate filament protein 0.0029 0.0124 0.0655
Brugia malayi RNase H family protein 0.0249 0.1771 1
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0143 0.0368
Brugia malayi 6-phosphofructokinase 0.0116 0.0776 0.4366
Echinococcus multilocularis lamin dm0 0.0029 0.0124 0.0444
Brugia malayi 6-phosphofructokinase 0.0116 0.0776 0.4366
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.004 0.005
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Schistosoma mansoni 6-phosphofructokinase 0.0116 0.0776 0.0739
Echinococcus multilocularis RNA directed DNA polymerase 0.0024 0.0092 0.0317
Trypanosoma brucei ingi protein (ORF1) 0.0273 0.1954 0.2445
Wolbachia endosymbiont of Brugia malayi thymidylate kinase 0.0077 0.0483 0.2561
Mycobacterium tuberculosis Probable reductase 0.0115 0.0769 0.8837
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0143 0.2596
Echinococcus multilocularis RNA directed DNA polymerase (reverse transcriptase) 0.0024 0.0092 0.0317
Echinococcus multilocularis lamin 0.0029 0.0124 0.0444
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.0059 0.0425
Trichomonas vaginalis reverse transcriptase [C. elegans], putative 0.0024 0.0092 0.0237
Echinococcus granulosus thioredoxin glutathione reductase 0.005 0.0286 0.1092
Trypanosoma cruzi ribonuclease H1, putative 0.0249 0.1771 0.4552
Loa Loa (eye worm) phosphofructokinase 0.0116 0.0776 0.4358
Toxoplasma gondii phosphofructokinase PFKII 0.0031 0.0143 0.0689
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Leishmania major ribonuclease H1, putative 0.0249 0.1771 0.4552
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0031 0.0143 0.0269
Brugia malayi phosphofructokinase 0.0116 0.0776 0.4366
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0059 0.0152
Trypanosoma brucei ribonuclease H1 0.0249 0.1771 0.2216
Schistosoma mansoni ap endonuclease 0.002 0.0059 0.0019
Schistosoma mansoni loxhd1 0.0024 0.0087 0.0048
Echinococcus granulosus RNA directed DNA polymerase reverse transcriptase 0.0024 0.0092 0.0317
Echinococcus multilocularis thymidylate kinase 0.0077 0.0483 0.1878
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.005 0.0286 0.2985
Plasmodium falciparum thioredoxin reductase 0.005 0.0286 0.5558
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0031 0.0143 0.0368
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0142 0.0975 0.3841
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0079 0.0204
Brugia malayi reverse transcriptase 0.0024 0.0092 0.0493
Trypanosoma brucei SLACS reverse transcriptase, putative 0.0024 0.0092 0.0115
Schistosoma mansoni rab6-interacting 0.0024 0.0087 0.0048
Brugia malayi Pao retrotransposon peptidase family protein 0.0024 0.0092 0.0493
Trypanosoma cruzi thymidylate kinase, putative 0.0077 0.0483 0.1242

Activities

Activity type Activity value Assay description Source Reference
Duration (functional) = 1.2 hr Duration of action where maximum inhibition of LTB4 formation is achieved at 1 mg/kg iv ChEMBL. 8246226
Duration (functional) = 1.2 hr Duration of action where maximum inhibition of LTB4 formation is achieved at 1 mg/kg iv ChEMBL. 8246226
Duration (functional) = 3.1 hr Duration of action is where maximum inhibition of LTB4 formation is achieved at 3 mg/kg po ChEMBL. 8246226
Duration (functional) = 3.1 hr Duration of action is where maximum inhibition of LTB4 formation is achieved at 3 mg/kg po ChEMBL. 8246226
Duration (functional) > 6 hr Duration of action where maximum inhibition of LTB4 formation is achieved at 10 mg/kg po ChEMBL. 8246226
Duration (functional) > 6 hr Duration of action where maximum inhibition of LTB4 formation is achieved at 10 mg/kg po ChEMBL. 8246226
IC50 (binding) = 3.6 uM In vitro inhibitory activity against 5-lipoxygenase by reduction of 5-hydroxyeicosatetraenoic acid (5-HETE) formed in guinea pig polymorphonuclear leukocytes (PMNs). ChEMBL. 8246226
IC50 (binding) = 3.6 uM In vitro inhibitory activity against 5-lipoxygenase by reduction of 5-hydroxyeicosatetraenoic acid (5-HETE) formed in guinea pig polymorphonuclear leukocytes (PMNs). ChEMBL. 8246226
IC50 (binding) = 3.9 uM In vitro inhibitory activity against 5-lipoxygenase by reduction of LTB4 formed in guinea pig polymorphonuclear leukocytes (PMNs). ChEMBL. 8246226
IC50 (binding) = 3.9 uM In vitro inhibitory activity against 5-lipoxygenase by reduction of LTB4 formed in guinea pig polymorphonuclear leukocytes (PMNs). ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 1 mg/kg iv ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 3 mg/kg po ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 10 mg/kg po ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 1 mg/kg iv ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 3 mg/kg po ChEMBL. 8246226
Inhibition (functional) > 95 % Ex vivo inhibition of LTB-4 determined by measurement of A-23,187-stimulated LTB-4 production in dog blood at 10 mg/kg po ChEMBL. 8246226

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

1 literature reference was collected for this gene.

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