Detailed information for compound 1177422

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 303.288 | Formula: C15H14FN3O3
  • H donors: 2 H acceptors: 3 LogP: 0.8 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccccc1)NC/C=C\Cn1cc(F)c(=O)[nH]c1=O
  • InChi: 1S/C15H14FN3O3/c16-12-10-19(15(22)18-14(12)21)9-5-4-8-17-13(20)11-6-2-1-3-7-11/h1-7,10H,8-9H2,(H,17,20)(H,18,21,22)/b5-4-
  • InChiKey: RBCDKXZRZZLDHU-PLNGDYQASA-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

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 granulosus pyruvate kinase 0.002 0.0223 0.0208
Brugia malayi Pyruvate kinase, M2 isozyme 0.0039 0.0737 0.1062
Echinococcus multilocularis beta LACTamase domain containing family member 0.0042 0.0808 0.0795
Plasmodium falciparum histone acetyltransferase GCN5 0.0043 0.0836 1
Onchocerca volvulus 0.0042 0.0808 0.1802
Plasmodium falciparum pyruvate kinase 2 0.002 0.0223 0.1952
Onchocerca volvulus 0.0166 0.4148 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0426 0.4616
Schistosoma mansoni DNA polymerase eta 0.0019 0.0184 0.0183
Mycobacterium tuberculosis Probable hydrolase 0.0042 0.0808 0.0981
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0308 0.3809
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0184 0.0169
Brugia malayi Isocitrate dehydrogenase 0.0017 0.0147 0.0212
Trichomonas vaginalis esterase, putative 0.0042 0.0808 0.8475
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0147 0.1821
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.1005 0.0992
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Schistosoma mansoni pyruvate kinase 0.002 0.0223 0.0222
Echinococcus granulosus heat shock protein 90 0.0036 0.0641 0.0628
Mycobacterium tuberculosis Probable lipase LipD 0.0042 0.0808 0.0981
Plasmodium vivax endoplasmin, putative 0.0036 0.0641 0.6817
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0808 0.8475
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0147 0.1537
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.0641 0.7932
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Trichomonas vaginalis endoplasmin, putative 0.0022 0.027 0.2259
Mycobacterium leprae Probable pyruvate kinase PykA 0.0039 0.0737 0.8034
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0184 0.0265
Brugia malayi hypothetical protein 0.0028 0.0426 0.0613
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.1005 0.1448
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Schistosoma mansoni DNA helicase recq5 0.0023 0.0308 0.0308
Trichomonas vaginalis bromodomain-containing protein, putative 0.0047 0.0941 1
Schistosoma mansoni DNA helicase recq1 0.0023 0.0308 0.0308
Trypanosoma cruzi heat shock protein 90, putative 0.0028 0.0446 0.551
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Mycobacterium tuberculosis Conserved protein 0.0042 0.0808 0.0981
Toxoplasma gondii pyruvate kinase PyK1 0.0039 0.0737 0.7836
Brugia malayi cytoplasmic intermediate filament protein 0.0016 0.0107 0.0155
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0159 0.3966 0.3966
Schistosoma mansoni hypothetical protein 0.0106 0.2542 0.2541
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0184 0.0054
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0808 0.8595
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0808 0.8475
Loa Loa (eye worm) hypothetical protein 0.0019 0.0184 0.0264
Trypanosoma cruzi Heat shock protein 83, putative 0.0036 0.0641 0.7932
Plasmodium vivax heat shock protein 90, putative 0.0015 0.0074 0.0785
Trichomonas vaginalis heat shock protein, putative 0.0028 0.0446 0.4288
Echinococcus granulosus histone acetyltransferase KAT2B 0.0155 0.3846 0.3837
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0737 0.1627
Echinococcus multilocularis musashi 0.003 0.0478 0.0464
Entamoeba histolytica heat shock protein 90, putative 0.0036 0.0641 0.7674
Schistosoma mansoni endoplasmin 0.0036 0.0641 0.0641
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0023 0.0308 0.0294
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0426 0.5098
Echinococcus granulosus GPCR family 2 0.0049 0.1005 0.0992
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0184 0.2
Plasmodium vivax heat shock protein, putative 0.0015 0.0074 0.0785
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Trypanosoma brucei pyruvate kinase 1, putative 0.0039 0.0737 0.9087
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0808 0.8475
Giardia lamblia Pyruvate kinase 0.002 0.0223 0.06
Trypanosoma cruzi heat shock protein, putative 0.0015 0.0074 0.0913
Trichomonas vaginalis heat shock protein, putative 0.0028 0.0446 0.4288
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0028 0.0446 0.0432
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.0808 0.0795
Toxoplasma gondii heat shock protein 90, putative 0.0036 0.0641 0.6817
Onchocerca volvulus 0.0042 0.0808 0.1802
Echinococcus granulosus bloom syndrome protein 0.0023 0.0308 0.0294
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0015 0.0074 0.006
Echinococcus granulosus lamin 0.003 0.0478 0.0464
Brugia malayi acetyltransferase, GNAT family protein 0.0159 0.3966 0.5717
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.0808 1
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0808 1
Mycobacterium ulcerans heat shock protein 90 0.0028 0.0446 0.4194
Schistosoma mansoni lamin 0.003 0.0478 0.0477
Onchocerca volvulus 0.003 0.0478 0.0991
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.1005 0.1448
Echinococcus multilocularis pyruvate kinase 0.002 0.0223 0.0208
Brugia malayi hypothetical protein 0.0018 0.0161 0.0233
Plasmodium vivax pyruvate kinase 2, putative 0.002 0.0223 0.2365
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0028 0.0446 0.5059
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Echinococcus multilocularis GPCR, family 2 0.0049 0.1005 0.0992
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0737 0.7652
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0184 0.0183
Plasmodium vivax heat shock protein 86, putative 0.0036 0.0641 0.6817
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0737 0.9117
Plasmodium falciparum endoplasmin, putative 0.0022 0.027 0.257
Mycobacterium leprae Probable lipase LipE 0.0042 0.0808 1
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0184 0.0265
Mycobacterium tuberculosis Conserved protein 0.0042 0.0808 0.0981
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0184 0.2268
Loa Loa (eye worm) hypothetical protein 0.0106 0.2542 0.3663
Echinococcus multilocularis lamin 0.003 0.0478 0.0464
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0737 0.9117
Giardia lamblia Pyruvate kinase 0.0039 0.0737 0.8489
Loa Loa (eye worm) heat shock protein 90 0.0036 0.0641 0.0924
Schistosoma mansoni hypothetical protein 0.0049 0.1005 0.1004
Toxoplasma gondii Hsp90 domain-containing protein 0.0015 0.0074 0.0785
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Loa Loa (eye worm) hypothetical protein 0.0028 0.0426 0.0613
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0023 0.0308 0.0294
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Giardia lamblia Sgs1 DNA helicase, putative 0.0023 0.0308 0.1911
Echinococcus granulosus dna polymerase kappa 0.0019 0.0184 0.0169
Schistosoma mansoni lamin 0.003 0.0478 0.0477
Brugia malayi isocitrate dehydrogenase 0.0017 0.0147 0.0212
Echinococcus granulosus pyruvate kinase 0.0039 0.0737 0.0724
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Brugia malayi latrophilin 2 splice variant baaae 0.0106 0.2542 0.3664
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0308 0.3274
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.0147 0.0147
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0737 0.7652
Loa Loa (eye worm) follicle stimulating hormone receptor 0.027 0.6937 1
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0308 0.2701
Trichomonas vaginalis heat shock protein, putative 0.0028 0.0446 0.4288
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0308 0.0294
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0147 0.0999
Mycobacterium ulcerans lipase LipD 0.0042 0.0808 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0478 0.0688
Trypanosoma cruzi heat shock protein 90, putative 0.0036 0.0641 0.7932
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0156 0.3866 0.5573
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.1005 0.0992
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.1005 0.0992
Entamoeba histolytica pyruvate kinase, putative 0.0027 0.0417 0.4992
Loa Loa (eye worm) hypothetical protein 0.003 0.0478 0.0688
Trypanosoma brucei heat shock protein 90, putative 0.0036 0.0641 0.7861
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.0808 1
Loa Loa (eye worm) hypothetical protein 0.0166 0.4148 0.5979
Loa Loa (eye worm) hypothetical protein 0.0027 0.0417 0.0601
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0426 0.4616
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.0808 0.1165
Loa Loa (eye worm) hypothetical protein 0.0156 0.3866 0.5572
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0017 0.0147 0.1565
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0017 0.0147 0.0963
Loa Loa (eye worm) intermediate filament protein 0.003 0.0478 0.0688
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Mycobacterium tuberculosis Probable lipase LipE 0.0042 0.0808 0.0981
Leishmania major pyruvate kinase 0.0039 0.0737 0.9028
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0039 0.0737 0.0875
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0147 0.0133
Toxoplasma gondii pyruvate kinase PyKII 0.002 0.0223 0.2365
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0042 0.0808 0.0981
Schistosoma mansoni heat shock protein 0.0015 0.0074 0.0074
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0065 0.0051
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Schistosoma mansoni heat shock protein 0.0036 0.0641 0.0641
Schistosoma mansoni hypothetical protein 0.0049 0.1005 0.1004
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0047 0.0941 1
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0308 0.0444
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0737 0.1062
Echinococcus granulosus endoplasmin 0.0028 0.0446 0.0432
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0184 0.2268
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.1005 0.0992
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0015 0.0074 0.006
Echinococcus multilocularis pyruvate kinase 0.0039 0.0737 0.0724
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Trichomonas vaginalis heat shock protein, putative 0.0036 0.0641 0.6547
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Brugia malayi beta-lactamase family protein 0.0042 0.0808 0.1165
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0042 0.0808 0.0981
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0184 0.0054
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0184 0.2
Echinococcus multilocularis pyruvate kinase 0.0031 0.0514 0.0501
Brugia malayi Endoplasmin precursor 0.0036 0.0641 0.0924
Plasmodium falciparum heat shock protein 90 0.0036 0.0641 0.7449
Brugia malayi intermediate filament protein 0.003 0.0478 0.0688
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Mycobacterium tuberculosis Conserved protein 0.0042 0.0808 0.0981
Echinococcus multilocularis heat shock protein 0.0036 0.0641 0.0628
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0268 0.6888 1
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.0147 0.0133
Brugia malayi Pyruvate kinase, muscle isozyme 0.0039 0.0737 0.1062
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0308 0.3274
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0023 0.0308 0.0444
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.0808 1
Schistosoma mansoni pyruvate kinase 0.0039 0.0737 0.0737
Giardia lamblia Histone acetyltransferase GCN5 0.0043 0.0836 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Loa Loa (eye worm) pyruvate kinase-PB 0.0027 0.0417 0.0601
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0808 0.0808
Loa Loa (eye worm) acetyltransferase 0.0159 0.3966 0.5716
Echinococcus multilocularis pyruvate kinase 0.002 0.0223 0.0208
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0426 0.5263
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.0147 0.0133
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0065 0.0051
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0159 0.3966 0.3957
Schistosoma mansoni pyruvate kinase 0.0039 0.0737 0.0737
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0017 0.0147 0.1537
Trypanosoma brucei heat shock protein 90, putative 0.0036 0.0641 0.7861
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Schistosoma mansoni intermediate filament proteins 0.003 0.0478 0.0477
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0184 0.2
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Echinococcus multilocularis lamin dm0 0.003 0.0478 0.0464
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0184 0.0183
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0184 0.1264
Trypanosoma brucei heat shock protein, putative 0.0036 0.0641 0.7861
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0737 0.1627
Leishmania major hypothetical protein, conserved 0.0028 0.0426 0.4787
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0147 0.0133
Mycobacterium ulcerans pyruvate kinase 0.0039 0.0737 0.8858
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0737 0.1627
Echinococcus granulosus heat shock protein 90 0.0028 0.0446 0.0432
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Loa Loa (eye worm) beta-lactamase 0.0042 0.0808 0.1165
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0737 0.1062
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0023 0.0308 0.0294
Loa Loa (eye worm) endoplasmin 0.0036 0.0641 0.0924
Mycobacterium ulcerans beta-lactamase 0.0042 0.0808 1
Trypanosoma brucei unspecified product 0.0019 0.0184 0.2
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0808 0.8475
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Toxoplasma gondii ABC1 family protein 0.0042 0.0808 0.8595
Giardia lamblia Heat shock protein HSP 90-alpha 0.0028 0.0446 0.4019
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Brugia malayi follicle stimulating hormone receptor 0.027 0.6937 1
Mycobacterium leprae conserved hypothetical protein 0.0042 0.0808 1
Echinococcus multilocularis heat shock protein 90 0.0028 0.0446 0.0432
Onchocerca volvulus 0.0042 0.0808 0.1802
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0808 1
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0028 0.0446 0.5
Giardia lamblia Heat shock protein HSP 90-alpha 0.0036 0.0641 0.7021
Echinococcus granulosus lamin dm0 0.003 0.0478 0.0464
Leishmania major DNA polymerase eta, putative 0.0019 0.0184 0.1491
Mycobacterium ulcerans hypothetical protein 0.0042 0.0808 1
Schistosoma mansoni hypothetical protein 0.0012 0.0015 0.0014
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0308 0.0444
Brugia malayi MH2 domain containing protein 0.0116 0.2794 0.4027
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0308 0.2701
Brugia malayi Latrophilin receptor protein 2 0.0049 0.1005 0.1448
Brugia malayi Hsp90 protein 0.0015 0.0074 0.0107
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0426 0.4523
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0184 0.0264
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0308 0.3187
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0107 0.0154
Trypanosoma cruzi heat shock protein 90, putative 0.0021 0.0247 0.3059
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0184 0.0169
Toxoplasma gondii heat shock protein HSP90 0.0036 0.0641 0.6817
Schistosoma mansoni endoplasmin 0.0036 0.0641 0.0641
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0156 0.3866 0.5572
Trypanosoma cruzi heat shock protein 85, putative 0.0028 0.0446 0.551
Echinococcus granulosus pyruvate kinase 0.0039 0.0737 0.0724
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0184 0.1264
Schistosoma mansoni hypothetical protein 0.0049 0.1005 0.1004
Echinococcus multilocularis pyruvate kinase 0.0039 0.0737 0.0724
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0184 0.1491
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0184 0.0169
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0047 0.0941 1
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0017 0.0147 0.1821
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.0808 0.1165
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0308 0.0444
Trypanosoma brucei pyruvate kinase 1 0.0039 0.0737 0.9087
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0184 0.2268
Trypanosoma brucei heat shock protein 84, putative 0.0015 0.0074 0.0598
Mycobacterium tuberculosis Probable esterase LipL 0.0042 0.0808 0.0981
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.0147 0.0133
Leishmania major hypothetical protein, conserved 0.0042 0.0808 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0184 0.2194
Loa Loa (eye worm) heat shock protein 75 0.0015 0.0074 0.0106
Loa Loa (eye worm) hypothetical protein 0.0029 0.0463 0.0667
Brugia malayi heat shock protein 90 0.0036 0.0641 0.0924
Leishmania major pyruvate kinase 0.0039 0.0737 0.9028
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0147 0.1565
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0023 0.0308 0.3074
Giardia lamblia Grp94/Hsp90 0.0028 0.0446 0.4019
Brugia malayi beta-lactamase 0.0042 0.0808 0.1165
Schistosoma mansoni heat shock protein 0.0036 0.0641 0.0641
Entamoeba histolytica recQ family helicase, putative 0.0023 0.0308 0.3686
Entamoeba histolytica heat shock protein 90, putative 0.0036 0.0641 0.7674
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0147 0.1565
Loa Loa (eye worm) RecQ helicase 0.0023 0.0308 0.0444
Echinococcus granulosus histone acetyltransferase KAT2B 0.0047 0.0941 0.0927
Onchocerca volvulus 0.003 0.0478 0.0991
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0147 0.0133
Echinococcus multilocularis dna polymerase eta 0.0019 0.0184 0.0169
Toxoplasma gondii heat shock protein 75, putative 0.0015 0.0074 0.0785
Loa Loa (eye worm) hypothetical protein 0.0039 0.0737 0.1062
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0308 0.2701
Brugia malayi beta-lactamase family protein 0.0042 0.0808 0.1165
Chlamydia trachomatis pyruvate kinase 0.0039 0.0737 0.5
Loa Loa (eye worm) hypothetical protein 0.0014 0.0065 0.0093
Loa Loa (eye worm) hypothetical protein 0.0023 0.0308 0.0444
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0047 0.0941 1
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0737 0.1062
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0184 0.2268
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.0147 0.0212
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0308 0.3595
Plasmodium falciparum pyruvate kinase 0.0039 0.0737 0.8707
Loa Loa (eye worm) hypothetical protein 0.0049 0.1005 0.1448
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0426 0.5263
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0023 0.0308 0.3074
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0808 0.8475
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0028 0.0446 0.0442
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Loa Loa (eye worm) hypothetical protein 0.0014 0.005 0.0072
Leishmania major DNA polymerase kappa, putative 0.0019 0.0184 0.1491
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.0641 0.7932
Echinococcus multilocularis pyruvate kinase 0.002 0.0223 0.0208
Echinococcus granulosus pyruvate kinase 0.002 0.0223 0.0208
Trichomonas vaginalis heat shock protein, putative 0.0022 0.027 0.2259
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0015 0.0074 0.0883
Schistosoma mansoni hypothetical protein 0.0049 0.1005 0.1004
Echinococcus granulosus intermediate filament protein 0.003 0.0478 0.0464
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0478 0.0688
Loa Loa (eye worm) hypothetical protein 0.0014 0.005 0.0072
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0184 0.2268
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0426 0.4523
Entamoeba histolytica acetyltransferase, GNAT family 0.0043 0.0836 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0156 0.3866 0.5573
Treponema pallidum heat shock protein 90 0.0028 0.0446 1
Trypanosoma brucei Heat shock protein 83, putative 0.0036 0.0641 0.7861
Brugia malayi hypothetical protein 0.0166 0.4148 0.5979
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.2794 0.4027
Echinococcus multilocularis endoplasmin 0.0028 0.0446 0.0432
Echinococcus multilocularis heat shock protein 90 0.0036 0.0641 0.0628
Echinococcus granulosus heat shock protein 0.0036 0.0641 0.0628
Loa Loa (eye worm) hypothetical protein 0.0042 0.0808 0.1165
Echinococcus granulosus pyruvate kinase 0.002 0.0223 0.0208
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0184 0.2
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0184 0.2
Trypanosoma cruzi heat shock protein 85, putative 0.0036 0.0641 0.7932
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.2794 0.4027
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0047 0.0941 1
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0023 0.0308 0.0294
Echinococcus granulosus dna polymerase eta 0.0019 0.0184 0.0169
Leishmania major heat shock protein 83-1 0.0036 0.0641 0.7724
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0042 0.0808 0.0981
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0808 0.0808
Plasmodium vivax pyruvate kinase, putative 0.0039 0.0737 0.7836

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 87.5 uM Cytotoxicity against human Hep2 cells after 72 hrs by MTT assay ChEMBL. 20696582
IC50 (functional) > 100 uM Cytotoxicity against human SK-BR-3 cells after 72 hrs by MTT assay ChEMBL. 20696582
IC50 (functional) > 100 uM Cytotoxicity against human HeLa cells after 72 hrs by MTT assay ChEMBL. 20696582
IC50 (functional) > 100 uM Cytotoxicity against human MCF7 cells after 72 hrs by MTT assay ChEMBL. 20696582
IC50 (functional) > 100 uM Cytotoxicity against human SW620 cells after 72 hrs by MTT assay ChEMBL. 20696582
IC50 (functional) > 100 uM Cytotoxicity against human MIAPaCa2 cells after 72 hrs by MTT assay ChEMBL. 20696582

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.