Detailed information for compound 935675

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 446.54 | Formula: C23H34N4O5
  • H donors: 3 H acceptors: 3 LogP: 1.83 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N(C(=N)N)Cc1ccccc1OC)C(=O)O)CC
  • InChi: 1S/C23H34N4O5/c1-5-17(6-2)32-20-12-16(22(29)30)11-18(21(20)26-14(3)28)27(23(24)25)13-15-9-7-8-10-19(15)31-4/h7-10,12,17-18,20-21H,5-6,11,13H2,1-4H3,(H3,24,25)(H,26,28)(H,29,30)/t18-,20+,21+/m0/s1
  • InChiKey: RKUIKBULKBAEKC-CEWLAPEOSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Neuraminidase Starlite/ChEMBL References
Influenza A virus (strain A/USSR/90/1977 H1N1) Neuraminidase Starlite/ChEMBL References
Influenza A virus Neuraminidase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Leishmania donovani ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trypanosoma congolense ubiquitin-protein ligase, putative Get druggable targets OG5_127739 All targets in OG5_127739
Candida albicans ubiquitin conjugating enzyme Get druggable targets OG5_127739 All targets in OG5_127739
Neospora caninum Ubiquitin carrier protein (EC 6.3.2.-), related Get druggable targets OG5_127739 All targets in OG5_127739
Echinococcus granulosus ubiquitin conjugating enzyme E2 N Get druggable targets OG5_127739 All targets in OG5_127739
Echinococcus multilocularis ubiquitin conjugating enzyme E2 N Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 Get druggable targets OG5_127739 All targets in OG5_127739
Trypanosoma brucei ubiquitin-protein ligase, putative Get druggable targets OG5_127739 All targets in OG5_127739
Entamoeba histolytica ubiquitin-conjugating enzyme family protein Get druggable targets OG5_127739 All targets in OG5_127739
Schistosoma japonicum ko:K10580 ubiquitin-conjugating enzyme E2 N, putative Get druggable targets OG5_127739 All targets in OG5_127739
Onchocerca volvulus Get druggable targets OG5_127571 All targets in OG5_127571
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 Get druggable targets OG5_127739 All targets in OG5_127739
Plasmodium berghei ubiquitin-conjugating enzyme E2 N, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Brugia malayi Ubiquitin conjugating enzyme protein 13 Get druggable targets OG5_127739 All targets in OG5_127739
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA Get druggable targets OG5_127571 All targets in OG5_127571
Schistosoma mansoni ubiquitin conjugating enzyme 13 Get druggable targets OG5_127739 All targets in OG5_127739
Leishmania mexicana ubiquitin-conjugating enzyme e2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Candida albicans post-replication repair Get druggable targets OG5_127739 All targets in OG5_127739
Plasmodium falciparum ubiquitin-conjugating enzyme E2 N, putative Get druggable targets OG5_127739 All targets in OG5_127739
Entamoeba histolytica protein tyrosine phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) Get druggable targets OG5_127571 All targets in OG5_127571
Leishmania major ubiquitin-conjugating enzyme e2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Brugia malayi ubiquitin conjugating enzyme protein 13 Get druggable targets OG5_127739 All targets in OG5_127739
Leishmania braziliensis ubiquitin-conjugating enzyme e2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Candida albicans C terminus of potential Low molecular weight phosphoTyrosine Phosphatase Get druggable targets OG5_127571 All targets in OG5_127571
Candida albicans ubiquitin-conjugating enzyme Get druggable targets OG5_127739 All targets in OG5_127739
Babesia bovis ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Toxoplasma gondii ubiquitin-conjugating enzyme subfamily protein Get druggable targets OG5_127739 All targets in OG5_127739
Plasmodium knowlesi ubiquitin-conjugating enzyme E2 N, putative Get druggable targets OG5_127739 All targets in OG5_127739
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein Get druggable targets OG5_127571 All targets in OG5_127571
Loa Loa (eye worm) phosphotyrosine protein phosphatase Get druggable targets OG5_127571 All targets in OG5_127571
Plasmodium vivax ubiquitin-conjugating enzyme E2 N, putative Get druggable targets OG5_127739 All targets in OG5_127739
Entamoeba histolytica protein tyrosine phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Candida albicans 3' exon of potential Low molecular weight phosphoTyrosine Phosphatase gene Get druggable targets OG5_127571 All targets in OG5_127571
Theileria parva ubiquitin-protein ligase, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Cryptosporidium parvum ubiquitin-conjugating enzyme Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Trypanosoma brucei gambiense ubiquitin-conjugating enzyme e2, putative,ubiquitin carrier protein, putative,ubiquitin-protein ligase, putative Get druggable targets OG5_127739 All targets in OG5_127739
Cryptosporidium hominis ubiquitin-conjugating enzyme Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Leishmania infantum ubiquitin-conjugating enzyme e2, putative Get druggable targets OG5_127739 All targets in OG5_127739
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative Get druggable targets OG5_127571 All targets in OG5_127571
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase Get druggable targets OG5_127571 All targets in OG5_127571
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
Schistosoma mansoni jumonji domain containing protein 0.0062 0.0395 0.0521
Loa Loa (eye worm) hypothetical protein 0.0101 0.0911 0.1202
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.004 0.0155
Echinococcus multilocularis acetylcholinesterase 0.0606 0.7579 0.7579
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.0046 0.0187 0.0918
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0248 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0032 0.0001 0.0001
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0101 0.0911 0.1202
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0102 0.093 0.1227
Echinococcus multilocularis carboxylesterase 5A 0.0606 0.7579 0.7579
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 0.0395 0.0521
Loa Loa (eye worm) acetylcholinesterase 1 0.0606 0.7579 1
Echinococcus granulosus neuropeptide s receptor 0.045 0.5521 0.7286
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0102 0.093 0.3679
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0156 0.1643 0.3651
Brugia malayi Carboxylesterase family protein 0.0102 0.093 0.1227
Brugia malayi Transient-receptor-potential like protein 0.0037 0.0066 0.0087
Onchocerca volvulus 0.0102 0.093 0.5555
Plasmodium vivax hypothetical protein, conserved 0.0035 0.004 0.1579
Trypanosoma brucei PAB1-binding protein , putative 0.0051 0.0248 1
Trypanosoma brucei ubiquitin-protein ligase, putative 0.0046 0.0187 0.7523
Mycobacterium tuberculosis Carboxylesterase LipT 0.0102 0.093 0.3679
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0032 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Leishmania major hypothetical protein, conserved 0.0051 0.0248 1
Loa Loa (eye worm) transcription factor SMAD2 0.024 0.2755 0.3635
Echinococcus granulosus short transient receptor potential channel 6 0.0066 0.0446 0.0588
Echinococcus granulosus para nitrobenzyl esterase 0.0102 0.093 0.1227
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.004 0.0052
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.0046 0.0187 0.0247
Brugia malayi isocitrate dehydrogenase 0.0032 0.0001 0.0001
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0001 0.0001
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0001 0.0001
Echinococcus granulosus acetylcholinesterase 0.0606 0.7579 1
Schistosoma mansoni hypothetical protein 0.0069 0.0489 0.0646
Echinococcus multilocularis isocitrate dehydrogenase 0.0032 0.0001 0.0001
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.004 0.1579
Trichomonas vaginalis ubiquitin-conjugating enzyme E2, putative 0.0046 0.0187 0.0918
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0141 0.1436 0.1895
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0156 0.1643 1
Echinococcus granulosus geminin 0.0165 0.1756 0.2317
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Brugia malayi Carboxylesterase family protein 0.0102 0.093 0.1227
Loa Loa (eye worm) hypothetical protein 0.0069 0.0489 0.0646
Echinococcus multilocularis acetylcholinesterase 0.0606 0.7579 0.7579
Echinococcus granulosus neuroligin 0.0102 0.093 0.1227
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.004 0.0155
Brugia malayi MH2 domain containing protein 0.024 0.2755 0.3635
Schistosoma mansoni BC026374 protein (S09 family) 0.0102 0.093 0.1227
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.0046 0.0187 0.7523
Schistosoma mansoni ubiquitin conjugating enzyme 13 0.0046 0.0187 0.0247
Echinococcus multilocularis transient receptor potential ion channel A 0.0096 0.0846 0.0846
Loa Loa (eye worm) MH2 domain-containing protein 0.024 0.2755 0.3635
Entamoeba histolytica ubiquitin-conjugating enzyme family protein 0.0046 0.0187 0.0252
Echinococcus granulosus TRP transient receptor potential channel 0.0037 0.0066 0.0087
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.004 0.1579
Loa Loa (eye worm) hypothetical protein 0.0099 0.089 0.1174
Loa Loa (eye worm) hypothetical protein 0.0037 0.0066 0.0087
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0362 0.4361 1
Onchocerca volvulus 0.0102 0.093 0.5555
Echinococcus multilocularis para nitrobenzyl esterase 0.0102 0.093 0.093
Plasmodium vivax ataxin-2 like protein, putative 0.0051 0.0248 1
Plasmodium falciparum ubiquitin-conjugating enzyme E2 N, putative 0.0046 0.0187 0.7523
Brugia malayi beta-lactamase family protein 0.0035 0.004 0.0052
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0102 0.093 0.5555
Schistosoma mansoni transient receptor potential channel 0.0066 0.0446 0.0588
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0102 0.093 0.1227
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 0.0395 0.0521
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0156 0.1643 1
Schistosoma mansoni transient receptor potential channel 0.0066 0.0446 0.0588
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Brugia malayi Calcitonin receptor-like protein seb-1 0.0101 0.0911 0.1202
Onchocerca volvulus Huntingtin homolog 0.0129 0.1279 0.7735
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0037 0.0066 0.0066
Loa Loa (eye worm) hypothetical protein 0.0051 0.0248 0.0327
Loa Loa (eye worm) beta-lactamase 0.0035 0.004 0.0052
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0606 0.7579 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Mycobacterium leprae conserved hypothetical protein 0.0035 0.004 0.5
Echinococcus granulosus neuropeptide receptor A26 0.045 0.5521 0.7286
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.004 0.0155
Loa Loa (eye worm) hypothetical protein 0.0606 0.7579 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.004 0.0052
Brugia malayi jmjC domain containing protein 0.0062 0.0395 0.0521
Brugia malayi Isocitrate dehydrogenase 0.0032 0.0001 0.0001
Echinococcus multilocularis neuroligin 0.0102 0.093 0.093
Entamoeba histolytica hypothetical protein 0.0103 0.0939 0.2009
Echinococcus granulosus carboxylesterase 5A 0.0606 0.7579 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.0402 0.053
Echinococcus granulosus histone acetyltransferase KAT2B 0.0137 0.1384 0.1826
Echinococcus granulosus lysine specific demethylase 5A 0.0062 0.0395 0.0521
Echinococcus granulosus histone acetyltransferase KAT2B 0.0041 0.0125 0.0164
Brugia malayi beta-lactamase family protein 0.0035 0.004 0.0052
Echinococcus granulosus BC026374 protein S09 family 0.0102 0.093 0.1227
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0156 0.1643 1
Onchocerca volvulus 0.0102 0.093 0.5555
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.004 0.0155
Echinococcus granulosus ubiquitin conjugating enzyme E2 N 0.0046 0.0187 0.0247
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0041 0.0125 0.5007
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.0156 0.1643 0.2167
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0101 0.0911 0.1202
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.004 0.0052
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0032 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0606 0.7579 1
Loa Loa (eye worm) ubiquitin conjugating enzyme protein 13 0.0046 0.0187 0.0247
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0041 0.0125 0.5007
Brugia malayi Carboxylesterase family protein 0.0102 0.093 0.1227
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0102 0.093 0.3679
Plasmodium vivax ubiquitin-conjugating enzyme E2 N, putative 0.0046 0.0187 0.7523
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0141 0.1436 0.1436
Echinococcus multilocularis short transient receptor potential channel 6 0.0066 0.0446 0.0446
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0248 1
Echinococcus multilocularis short transient receptor potential channel 6 0.0066 0.0446 0.0446
Brugia malayi beta-lactamase 0.0035 0.004 0.0052
Loa Loa (eye worm) acetyltransferase 0.0141 0.1436 0.1895
Echinococcus multilocularis lysine specific demethylase 5A 0.0062 0.0395 0.0395
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.004 0.0155
Onchocerca volvulus 0.0156 0.1643 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0032 0.0001 0.0001
Schistosoma mansoni gliotactin 0.0102 0.093 0.1227
Giardia lamblia DNA repair protein RAD52 0.0362 0.4361 1
Echinococcus multilocularis transient receptor potential gamma protein 0.0099 0.089 0.089
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0102 0.093 0.1227
Toxoplasma gondii ubiquitin-conjugating enzyme subfamily protein 0.0046 0.0187 0.7523
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.004 0.0052
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0102 0.093 0.1227
Mycobacterium tuberculosis Conserved protein 0.0035 0.004 0.0155
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.004 0.1579
Echinococcus multilocularis neuropeptide s receptor 0.045 0.5521 0.5521
Brugia malayi jmjC domain containing protein 0.0062 0.0395 0.0521
Trypanosoma cruzi ubiquitin-conjugating enzyme E2, putative 0.0046 0.0187 0.7523
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0156 0.1643 1
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0156 0.1643 0.3651
Echinococcus multilocularis geminin 0.0165 0.1756 0.1756
Loa Loa (eye worm) carboxylesterase 0.0102 0.093 0.1227
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0062 0.0395 0.0395
Mycobacterium tuberculosis Conserved protein 0.0035 0.004 0.0155
Brugia malayi hypothetical protein 0.0102 0.093 0.1227
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0156 0.1643 1
Brugia malayi Carboxylesterase family protein 0.0606 0.7579 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0051 0.0248 1
Brugia malayi hypothetical protein 0.0129 0.1279 0.1688
Schistosoma mansoni hypothetical protein 0.0165 0.1756 0.2317
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.0489 0.0646
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0102 0.093 0.093
Loa Loa (eye worm) carboxylesterase 0.0606 0.7579 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0038 0.0079 0.3168
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Mycobacterium ulcerans carboxylesterase, LipT 0.0102 0.093 0.5555
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Brugia malayi Carboxylesterase family protein 0.0606 0.7579 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.004 0.0052
Leishmania major hypothetical protein, conserved 0.0035 0.004 0.1579
Trichomonas vaginalis bromodomain-containing protein, putative 0.0041 0.0125 0.0529
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0041 0.0125 0.5007
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0156 0.1643 0.3651
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.004 0.0052
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0156 0.1643 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.004 0.0155
Trichomonas vaginalis spcc417.12 protein, putative 0.0102 0.093 0.5555
Trypanosoma cruzi PAB1-binding protein , putative 0.0051 0.0248 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0223 0.2527 1
Mycobacterium tuberculosis Conserved protein 0.0035 0.004 0.0155
Echinococcus granulosus transient receptor potential gamma protein 0.0099 0.089 0.1174
Brugia malayi hypothetical protein 0.0051 0.0248 0.0327
Toxoplasma gondii ABC1 family protein 0.0035 0.004 0.1579
Brugia malayi Ubiquitin conjugating enzyme protein 13 0.0046 0.0187 0.0247
Echinococcus granulosus acetylcholinesterase 0.0606 0.7579 1
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0156 0.1643 1
Brugia malayi ubiquitin conjugating enzyme protein 13 0.0046 0.0187 0.0247
Echinococcus multilocularis BC026374 protein (S09 family) 0.0102 0.093 0.093
Onchocerca volvulus 0.0102 0.093 0.5555
Loa Loa (eye worm) hypothetical protein 0.0129 0.1279 0.1688
Loa Loa (eye worm) hypothetical protein 0.0102 0.093 0.1227
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.004 0.0155
Brugia malayi hypothetical protein 0.0033 0.0011 0.0014
Brugia malayi acetyltransferase, GNAT family protein 0.0141 0.1436 0.1895
Loa Loa (eye worm) hypothetical protein 0.0129 0.1279 0.1688
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 0.0395 0.0521
Brugia malayi Carboxylesterase family protein 0.0102 0.093 0.1227
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0156 0.1643 0.65
Toxoplasma gondii LsmAD domain-containing protein 0.0051 0.0248 1
Schistosoma mansoni acetylcholinesterase 0.0102 0.093 0.1227
Loa Loa (eye worm) carboxylesterase 0.0102 0.093 0.1227
Schistosoma mansoni neuroligin 3 (S09 family) 0.0102 0.093 0.1227
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0041 0.0125 0.0529
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0062 0.0395 0.0521
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0156 0.1643 0.2167
Echinococcus granulosus transient receptor potential ion channel A 0.0096 0.0846 0.1116
Schistosoma mansoni transient receptor potential channel 0.0099 0.089 0.1174
Schistosoma mansoni hypothetical protein 0.0165 0.1756 0.2317
Mycobacterium leprae Probable lipase LipE 0.0035 0.004 0.5
Schistosoma mansoni transient receptor potential channel 4 0.0099 0.089 0.1174
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.004 0.004
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0103 0.0939 0.2009
Onchocerca volvulus 0.0102 0.093 0.5555
Onchocerca volvulus Huntingtin homolog 0.0129 0.1279 0.7735
Echinococcus granulosus short transient receptor potential channel 6 0.0066 0.0446 0.0588
Echinococcus multilocularis ubiquitin conjugating enzyme E2 N 0.0046 0.0187 0.0187
Leishmania major ubiquitin-conjugating enzyme e2, putative 0.0046 0.0187 0.7523
Loa Loa (eye worm) hypothetical protein 0.0034 0.0022 0.0029
Echinococcus multilocularis neuropeptide receptor A26 0.045 0.5521 0.5521

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.25 uM Inhibition of Influenza A virus A/duck/china/1206/2012(H5N1) Neuraminidase ChEMBL. 25255388
IC50 (binding) = 0.36 uM Inhibition of Influenza A virus A/chicken/shandong/S2/02(H9N2) Neuraminidase ChEMBL. 25255388
IC50 (binding) = 0.49 uM Inhibition of Influenza A virus A/chicken/china/415/2013(H9N2) Neuraminidase N2 ChEMBL. 25255388
IC50 (binding) = 0.55 uM Inhibition of Influenza A virus A/chicken/china/1220/2012(H5N1) Neuraminidase N1 ChEMBL. 25255388
IC50 (binding) = 0.55 uM Inhibition of Influenza A virus A/duck/china/QJ/01(H5N1) Neuraminidase ChEMBL. 25255388

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.
 
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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