Detailed information for compound 2192885

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 335.054 | Formula: C14H13ClF3NO3
  • H donors: 1 H acceptors: 1 LogP: 4.12 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 0
  • SMILES: CC(=CCO[C@@]1(OC(=O)Nc2c1cc(Cl)cc2)C(F)(F)F)C
  • InChi: InChI=1S/C14H13ClF3NO3/c1-8(2)5-6-21-13(14(16,17)18)10-7-9(15)3-4-11(10)19-12(20)22-13/h3-5,7H,6H2,1-2H3,(H,19,20)/t13-/m0/s1
  • InChiKey: LNSLBESECFQUJH-ZDUSSCGKSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis 6 phosphofructokinase 0.0107 0.1415 0.1415
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0355 0.0355
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.012 0.1522
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0355 0.0355
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.012 0.1481
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0515 0.0708
Plasmodium falciparum plasmepsin I 0.005 0.0562 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0085 0.0085
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0703 0.215
Schistosoma mansoni ceramide glucosyltransferase 0.0479 0.7028 0.7022
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0399 0.0381
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0092 0.0524
Leishmania major DNA polymerase kappa, putative 0.0019 0.0092 0.0524
Leishmania major DNA polymerase eta, putative 0.0019 0.0092 0.0524
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0092 0.0073
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0243 0.3891
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0231 0.1609
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0085 0.0844
Echinococcus granulosus survival motor neuron protein 1 0.023 0.3267 0.3267
Mycobacterium ulcerans carbon monoxide dehydrogenase 0.0225 0.3199 1
Loa Loa (eye worm) hypothetical protein 0.005 0.0562 0.0799
Schistosoma mansoni bromodomain containing protein 0.0062 0.074 0.0723
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1415 0.2747
Echinococcus multilocularis lamin dm0 0.0026 0.0204 0.0204
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0341 0.0323
Echinococcus multilocularis snurportin 1 0.0299 0.4311 0.4311
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0092 0.0524
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0059 0.0703 0.3104
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0236 0.3357 0.4777
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0041 0.0258
Brugia malayi Cytochrome P450 family protein 0.0051 0.0582 0.0804
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.012 0.012
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.012 0.1522
Toxoplasma gondii exonuclease III APE 0.0018 0.0085 0.0964
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0085 0.0094
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0355 0.2409
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0148 0.0211
Trypanosoma cruzi ISWI complex protein 0.0015 0.0035 0.0114
Entamoeba histolytica hypothetical protein 0.0035 0.0341 0.1927
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0041 0.0321
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.005 0.0562 0.7937
Schistosoma mansoni netrin receptor unc5 0.0014 0.0022 0.0003
Loa Loa (eye worm) 6-phosphofructokinase 0.0107 0.1415 0.2013
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.012 0.0725
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0231 0.1609
Brugia malayi Ceramide glucosyltransferase 0.0479 0.7028 1
Brugia malayi Bromodomain containing protein 0.0037 0.0373 0.0505
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0029 0.0243 0.5
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0021 0.003
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.0479 0.7028 1
Treponema pallidum hypothetical protein 0.0045 0.0495 0.3082
Echinococcus granulosus 6 phosphofructokinase 0.0107 0.1415 0.1415
Brugia malayi phosphofructokinase 0.0107 0.1415 0.1992
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0092 0.0621
Loa Loa (eye worm) inositol-1 0.0036 0.0355 0.0505
Plasmodium falciparum plasmepsin II 0.005 0.0562 1
Echinococcus granulosus nuclear factor of activated T cells 5 0.0072 0.0897 0.0897
Mycobacterium ulcerans hypothetical protein 0.0055 0.0641 0.1958
Onchocerca volvulus 0.0047 0.0515 0.0704
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0243 0.3891
Echinococcus granulosus importin subunit beta 1 0.0028 0.0231 0.0231
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0041 0.0041
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0355 0.2409
Loa Loa (eye worm) ceramide glucosyltransferase 0.0479 0.7028 1
Leishmania major ATP-dependent phosphofructokinase 0.0107 0.1415 1
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0092 0.0015
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0092 0.0104
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.006 0.006
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0141 0.0141
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.3267 0.3267
Brugia malayi Bromodomain containing protein 0.0073 0.0913 0.1275
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0355 0.2409
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0085 0.0844
Loa Loa (eye worm) hypothetical protein 0.0026 0.0204 0.029
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0014 0.0022 0.0022
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1415 1
Trypanosoma brucei unspecified product 0.0019 0.0092 0.0621
Brugia malayi PHD-finger family protein 0.0024 0.0176 0.0224
Echinococcus granulosus cytochrome P450 2K1 0.0014 0.0019 0.0019
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Treponema pallidum hypothetical protein 0.0055 0.0641 0.4186
Schistosoma mansoni ap endonuclease 0.0018 0.0085 0.0066
Loa Loa (eye worm) hypothetical protein 0.0014 0.0022 0.0031
Echinococcus granulosus intermediate filament protein 0.0026 0.0204 0.0204
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Brugia malayi follicle stimulating hormone receptor 0.0236 0.3357 0.4763
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0072 0.0897 0.0897
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.012 0.0144
Mycobacterium tuberculosis Probable carbon monoxyde dehydrogenase (large chain) 0.016 0.2222 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0051 0.0582 0.0828
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0092 0.0073
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.006 0.0042
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Echinococcus granulosus ceramide glucosyltransferase 0.0479 0.7028 0.7028
Brugia malayi intermediate filament protein 0.0026 0.0204 0.0264
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.006 0.006
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0041 0.0258
Echinococcus granulosus death domain containing protein 0.0014 0.0022 0.0022
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0036 0.0349 0.0349
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0014 0.0022 0.0031
Trichomonas vaginalis aldehyde oxidase, putative 0.034 0.4926 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.006 0.0042
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0069 0.0099
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0703 0.215
Echinococcus multilocularis protein will die slowly 0.0129 0.1759 0.1759
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0204 0.029
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1415 0.2747
Loa Loa (eye worm) aspartic protease BmAsp-2 0.005 0.0562 0.0799
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0036 0.0355 0.2033
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.0688 0.0688
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.006 0.0042
Schistosoma mansoni DNA polymerase eta 0.0019 0.0092 0.0073
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0107 0.1415 1
Toxoplasma gondii aspartyl protease ASP1 0.005 0.0562 0.7937
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0036 0.0349 0.0471
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0085 0.0472
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0152 0.0138
Schistosoma mansoni hypothetical protein 0.002 0.0113 0.0095
Mycobacterium ulcerans aldehyde dehydrogenase 0.0059 0.0703 0.215
Treponema pallidum quinoline 2-oxidoreductase 0.0054 0.0622 0.404
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0041 0.0031
Schistosoma mansoni cathepsin D (A01 family) 0.0147 0.2026 0.2011
Mycobacterium ulcerans aerobic-type carbon monoxide dehydrogenase subunit CoxL_2 0.016 0.2222 0.6928
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.012 0.0725
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0014 0.0022 0.0022
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.012 0.012
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0152 0.0952
Schistosoma mansoni hypothetical protein 0.0015 0.0035 0.0016
Echinococcus multilocularis lamin 0.0026 0.0204 0.0204
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.005 0.0562 0.0562
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Brugia malayi hypothetical protein 0.0119 0.1607 0.2266
Entamoeba histolytica hypothetical protein 0.0035 0.0341 0.1927
Loa Loa (eye worm) hypothetical protein 0.0037 0.0374 0.0532
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0299 0.4311 0.6134
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0041 0.0041
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0341 0.0341
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0085 0.0207
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Leishmania major importin beta-1 subunit, putative 0.0023 0.0152 0.0952
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0092 0.0104
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0355 0.2487
Brugia malayi Protein kinase domain containing protein 0.0014 0.0022 0.0005
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0085 0.0121
Brugia malayi Importin beta-1 subunit 0.0028 0.0231 0.0303
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0152 0.0138
Loa Loa (eye worm) hypothetical protein 0.0026 0.0197 0.028
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0355 0.0559
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0036 0.0349 0.0349
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0399 0.0381
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0031 0.0278 0.0395
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0041 0.0157
Schistosoma mansoni inositol monophosphatase 0.0036 0.0355 0.0337
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0141 0.0123
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0085 0.0472
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0092 0.0524
Brugia malayi 6-phosphofructokinase 0.0107 0.1415 0.1992
Echinococcus granulosus lamin dm0 0.0026 0.0204 0.0204
Schistosoma mansoni ap endonuclease 0.0018 0.0085 0.0066
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0107 0.1415 1
Echinococcus granulosus lamin 0.0026 0.0204 0.0204
Plasmodium vivax aspartyl proteinase, putative 0.005 0.0562 1
Echinococcus granulosus tm gpcr rhodopsin 0.0524 0.7696 0.7696
Mycobacterium ulcerans carbon monoxyde dehydrogenase medium chain CoxM 0.0115 0.1537 0.4775
Trypanosoma brucei cytochrome P450, putative 0.0022 0.0148 0.102
Schistosoma mansoni zinc finger protein 0.0019 0.0098 0.0079
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0092 0.0092
Schistosoma mansoni hypothetical protein 0.0035 0.0341 0.0323
Brugia malayi 6-phosphofructokinase 0.0107 0.1415 0.1992
Echinococcus multilocularis microtubule associated protein 2 0.0677 1 1
Brugia malayi hypothetical protein 0.023 0.3267 0.4635
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.0688 0.0688
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Loa Loa (eye worm) hypothetical protein 0.0042 0.0437 0.0622
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0041 0.0058
Mycobacterium ulcerans aerobic-type carbon monoxide dehydrogenase subunit CoxM_2 0.0115 0.1537 0.4775
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0041 0.0041
Schistosoma mansoni hypothetical protein 0.0014 0.0022 0.0003
Echinococcus granulosus zinc finger protein 0.0019 0.0098 0.0098
Toxoplasma gondii aldehyde dehydrogenase 0.0059 0.0703 1
Entamoeba histolytica Ran family GTPase 0.0021 0.012 0.0265
Schistosoma mansoni lamin 0.0026 0.0204 0.0186
Plasmodium vivax importin-beta 2, putative 0.0028 0.0231 0.366
Echinococcus granulosus protein will die slowly 0.0129 0.1759 0.1759
Brugia malayi isocitrate dehydrogenase 0.0015 0.0041 0.0031
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0092 0.0092
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1415 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0014 0.0022 0.0005
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.0148 0.0927
Trichomonas vaginalis ran, putative 0.0021 0.012 0.0073
Schistosoma mansoni lamin 0.0026 0.0204 0.0186
Schistosoma mansoni 6-phosphofructokinase 0.0107 0.1415 0.1399
Leishmania major GTP-binding protein, putative 0.0021 0.012 0.0725
Entamoeba histolytica phosphofructokinase, putative 0.0107 0.1415 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0092 0.0131
Schistosoma mansoni hypothetical protein 0.0047 0.0515 0.0497
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0355 0.4919
Schistosoma mansoni inositol monophosphatase 0.0036 0.0355 0.0337
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0092 0.0015
Trichomonas vaginalis xanthine dehydrogenase, putative 0.034 0.4926 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.006 0.0086
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0041 0.0157
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Schistosoma mansoni importin beta-1 0.0028 0.0231 0.0213
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0092 0.0524
Onchocerca volvulus 0.0129 0.1759 0.248
Entamoeba histolytica hypothetical protein 0.0023 0.0152 0.0503
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.005 0.0562 0.0985
Schistosoma mansoni ran 0.0021 0.012 0.0101
Loa Loa (eye worm) hypothetical protein 0.023 0.3267 0.4649
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0152 0.0138
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.006 0.006
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0231 0.0231
Plasmodium falciparum importin beta, putative 0.0028 0.0231 0.366
Loa Loa (eye worm) hypothetical protein 0.0014 0.0024 0.0034
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1415 0.2747
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0085 0.0085
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0032 0.0298 0.1267
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0092 0.0621
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0085 0.057
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0092 0.023
Toxoplasma gondii phosphofructokinase PFKII 0.0029 0.0243 0.3284
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.012 0.082
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0015 0.0041 0.01
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.005 0.0562 0.0562
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0041 0.0157
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0703 0.0685
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0243 0.3891
Brugia malayi Death domain containing protein 0.0014 0.0022 0.0005
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0092 0.0524
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0355 0.0559
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0085 0.0299
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0355 0.1058
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Echinococcus granulosus Ankyrin 0.0014 0.0024 0.0024
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0041 0.0041
Schistosoma mansoni intermediate filament proteins 0.0026 0.0204 0.0186
Echinococcus granulosus snurportin 1 0.0299 0.4311 0.4311
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0029 0.0243 0.0328
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0029 0.0243 0.3284
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0113 0.0161
Echinococcus multilocularis netrin receptor unc 5 0.0014 0.0022 0.0022
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0141 0.0141
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0204 0.029
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0014 0.0019 0.0102
Trichomonas vaginalis xanthine dehydrogenase, putative 0.034 0.4926 1
Brugia malayi Inositol-1 0.0036 0.0355 0.048
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0085 0.0472
Mycobacterium tuberculosis Probable carbon monoxyde dehydrogenase (medium chain) 0.0115 0.1537 0.6891
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.012 0.0118
Loa Loa (eye worm) cytochrome P450 0.0014 0.0019 0.0027
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0092 0.0092
Mycobacterium ulcerans carbon monoxyde dehydrogenase large chain CoxL 0.0101 0.1326 0.4112
Echinococcus multilocularis zinc finger protein 0.0019 0.0098 0.0098
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0059 0.0703 0.4899
Toxoplasma gondii 6-phosphofructokinase 0.0029 0.0243 0.3284
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0092 0.0524
Brugia malayi Uncoordinated protein 44 0.0014 0.0022 0.0005
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0029 0.0243 0.0529
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0341 0.0341
Plasmodium falciparum plasmepsin IV 0.005 0.0562 1
Echinococcus multilocularis dna polymerase eta 0.0019 0.0092 0.0092
Mycobacterium tuberculosis Probable carbon monoxyde dehydrogenase (small chain) 0.0065 0.0787 0.3485
Schistosoma mansoni survival motor neuron protein 0.0047 0.0515 0.0497
Trypanosoma cruzi ISWI complex protein 0.0015 0.0035 0.0114
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0029 0.0243 0.1193
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0041 0.0041
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0036 0.0349 0.0497
Loa Loa (eye worm) hypothetical protein 0.004 0.0409 0.0582
Brugia malayi Cytochrome P450 family protein 0.0022 0.0148 0.0185
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0107 0.1415 1
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0243 0.0328
Trichomonas vaginalis WD repeat domain, putative 0.0129 0.1759 0.3459
Brugia malayi RNA, U transporter 1 0.008 0.1009 0.1412
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0148 0.0211
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0092 0.0332
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.006 0.0042
Giardia lamblia DINP protein human, muc B family 0.0019 0.0092 0.0024
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0092 0.0621
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0022 0.0148 0.0407
Brugia malayi hypothetical protein 0.0035 0.0341 0.046
Echinococcus multilocularis ceramide glucosyltransferase 0.0479 0.7028 0.7028
Schistosoma mansoni zinc finger protein 0.0015 0.0035 0.0016
Mycobacterium ulcerans 6-phosphofructokinase 0.0107 0.1415 0.439
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0092 0.0621
Entamoeba histolytica hypothetical protein 0.0035 0.0341 0.1927
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0029 0.0243 0.5
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0032 0.0298 0.2
Echinococcus multilocularis musashi 0.0026 0.0204 0.0204
Onchocerca volvulus 0.0026 0.0204 0.026
Schistosoma mansoni 6-phosphofructokinase 0.0107 0.1415 0.1399
Brugia malayi Will die slowly protein 0.0129 0.1759 0.2483
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0092 0.0131
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0041 0.0041
Schistosoma mansoni ankyrin 23/unc44 0.0014 0.0022 0.0003
Plasmodium falciparum plasmepsin VI 0.005 0.0562 1
Echinococcus granulosus dna polymerase kappa 0.0019 0.0092 0.0092
Mycobacterium ulcerans carbon monoxyde dehydrogenase small chain CoxS 0.0065 0.0787 0.2414
Mycobacterium ulcerans carbon monoxyde dehydrogenase large chain CoxL 0.016 0.2222 0.6928
Loa Loa (eye worm) hypothetical protein 0.0311 0.4494 0.6395
Echinococcus multilocularis 0.0014 0.0019 0.0019
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0041 0.0321
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0092 0.0332
Plasmodium vivax plasmepsin IV, putative 0.005 0.0562 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.085 0.1209
Echinococcus granulosus dna polymerase eta 0.0019 0.0092 0.0092
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0092 0.023
Leishmania major cytochrome p450-like protein 0.0022 0.0148 0.0927
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0107 0.1415 0.6336
Mycobacterium ulcerans carbon monoxyde dehydrogenase small chain CoxS 0.0065 0.0787 0.2414
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0231 0.3109
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0033 0.0314 0.0473
Echinococcus granulosus netrin receptor unc 5 0.0014 0.0022 0.0022
Schistosoma mansoni hypothetical protein 0.0129 0.1759 0.1744
Trypanosoma cruzi cytochrome P450, putative 0.0022 0.0148 0.0927
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0014 0.0024 0.0005
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0092 0.0054
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0355 0.0559
Brugia malayi Cytochrome P450 family protein 0.0022 0.0148 0.0185
Leishmania major hypothetical protein, conserved 0.0015 0.0035 0.0114
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0092 0.0621
Loa Loa (eye worm) hypothetical protein 0.0028 0.0231 0.0329
Schistosoma mansoni microtubule-associated protein tau 0.0677 1 1
Entamoeba histolytica hypothetical protein 0.0035 0.0341 0.1927
Loa Loa (eye worm) WD40 repeat protein 0.0129 0.1759 0.2504
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0243 0.3891
Schistosoma mansoni ran 0.0021 0.012 0.0101
Loa Loa (eye worm) phosphofructokinase 0.0107 0.1415 0.2013
Trypanosoma brucei ISWI complex protein 0.0015 0.0035 0.0215
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.005 0.0562 0.0544
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0041 0.0022
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0338 0.0338
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0107 0.1415 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0524 0.7696 0.7696
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0029 0.0243 0.1193
Schistosoma mansoni ceramide glucosyltransferase 0.0479 0.7028 0.7022
Onchocerca volvulus 0.0026 0.0204 0.026
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0338 0.0338
Schistosoma mansoni cathepsin D (A01 family) 0.0147 0.2026 0.2011
Loa Loa (eye worm) CYP4Cod1 0.0022 0.0148 0.0211
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.012 0.0171
Echinococcus multilocularis Ankyrin 0.0014 0.0024 0.0024
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0033 0.0314 0.0473
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0.0355 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0059 0.0703 0.0703
Schistosoma mansoni aldehyde dehydrogenase 0.0059 0.0703 0.0685
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0059 0.0703 0.0703
Trichomonas vaginalis phosphofructokinase, putative 0.0107 0.1415 0.2747
Brugia malayi cytoplasmic intermediate filament protein 0.0014 0.0021 0.0003
Loa Loa (eye worm) 6-phosphofructokinase 0.0107 0.1415 0.2013
Giardia lamblia Ceramide glucosyltransferase 0.0217 0.3082 1
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0204 0.0264
Schistosoma mansoni hypothetical protein 0.0299 0.4311 0.43

Activities

Activity type Activity value Assay description Source Reference
IC90 (binding) = 2.68 nM Inhibition of HIV1 reverse transcriptase ChEMBL. 26708112

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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