Detailed information for compound 1742701

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 357.831 | Formula: C20H20ClNO3
  • H donors: 1 H acceptors: 3 LogP: 3.72 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O[C@H]1CC(=O)O[C@@H](C1)/C=C/c1c(C)nc(cc1c1ccc(cc1)Cl)C
  • InChi: 1S/C20H20ClNO3/c1-12-9-19(14-3-5-15(21)6-4-14)18(13(2)22-12)8-7-17-10-16(23)11-20(24)25-17/h3-9,16-17,23H,10-11H2,1-2H3/b8-7+/t16-,17-/m1/s1
  • InChiKey: YUDMEWWJTJHMSU-NXVGNOFTSA-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
Rattus norvegicus HMG-CoA reductase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania donovani 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Leishmania infantum 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Candida albicans hydroxymethylglutaryl-CoA reductase (ergosterol biosynthesis) Get druggable targets OG5_127955 All targets in OG5_127955
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) Get druggable targets OG5_127955 All targets in OG5_127955
Schistosoma japonicum ko:K00021 3-hydroxy-3-methylglutaryl-CoA reductase [EC1.1.1.34], putative Get druggable targets OG5_127955 All targets in OG5_127955
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase Get druggable targets OG5_127955 All targets in OG5_127955
Leishmania mexicana 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Trypanosoma congolense 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase Get druggable targets OG5_127955 All targets in OG5_127955
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase Get druggable targets OG5_127955 All targets in OG5_127955
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein Get druggable targets OG5_127955 All targets in OG5_127955
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase Get druggable targets OG5_127955 All targets in OG5_127955
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Trypanosoma brucei gambiense 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase Get druggable targets OG5_127955 All targets in OG5_127955
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127955 All targets in OG5_127955
Candida albicans hydroxymethylglutaryl-CoA reductase (ergosterol biosynthesis) Get druggable targets OG5_127955 All targets in OG5_127955
Leishmania braziliensis 3-hydroxy-3-methylglutaryl-CoA reductase, putative Get druggable targets OG5_127955 All targets in OG5_127955
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
Plasmodium vivax endoplasmin, putative 0.0044 0.0092 0.2074
Brugia malayi hypothetical protein 0.003 0.0051 0.0055
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Trypanosoma cruzi heat shock protein 85, putative 0.0038 0.0074 0.1666
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0038 0.0074 0.0078
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0044 0.0047
Onchocerca volvulus Cell death protein 3 homolog 0.003 0.0051 0.156
Onchocerca volvulus Heat shock protein 75 kDa, mitochondrial homolog 0.0029 0.005 0.1521
Echinococcus multilocularis smad 0.0016 0.0012 0.0012
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0064 0.0149 0.0158
Onchocerca volvulus 0.0037 0.0072 0.2204
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0078 0.0187 0.1135
Schistosoma mansoni cpg binding protein 0.0028 0.0045 0.0047
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0009 0.0184
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Schistosoma mansoni smad1 5 8 and 0.0016 0.0012 0.0012
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0046 0.0049
Trypanosoma cruzi heat shock protein 85, putative 0.0044 0.0092 0.2085
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Echinococcus multilocularis transcription factor eb 0.0104 0.0264 0.0281
Brugia malayi hypothetical protein 0.002 0.0024 0.0026
Loa Loa (eye worm) hypothetical protein 0.0013 0.0003 0.0003
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.0092 0.0553
Schistosoma mansoni hypothetical protein 0.0016 0.0013 0.0012
Schistosoma mansoni patched 1 0.0153 0.0402 0.0429
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0037 0.0072 0.0063
Echinococcus granulosus GPCR family 2 0.0016 0.0013 0.0012
Onchocerca volvulus Chorion peroxidase homolog 0.0027 0.0044 0.1329
Brugia malayi CHE-14 protein 0.0153 0.0402 0.043
Loa Loa (eye worm) hypothetical protein 0.0153 0.0402 0.043
Onchocerca volvulus 0.0027 0.0044 0.1329
Mycobacterium tuberculosis Conserved protein 0.0037 0.0072 0.0063
Schistosoma mansoni polycystin 1-related 0.002 0.0024 0.0024
Entamoeba histolytica hypothetical protein 0.0072 0.0172 0.104
Echinococcus granulosus microtubule associated protein 2 0.0715 0.2009 0.2148
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0044 0.0047
Echinococcus multilocularis Niemann Pick C1 protein 0.035 0.0966 0.1032
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0238 0.0647 0.0638
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0013 0.0004 0.0003
Leishmania major hypothetical protein, conserved 0.0037 0.0072 0.1625
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0064 0.0149 0.016
Treponema pallidum fructose-bisphosphate aldolase 0.0586 0.1639 1
Echinococcus granulosus Protein patched homolog 1 0.0153 0.0402 0.0429
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0042 0.0085 0.0038
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.0078 0.0187 0.1135
Echinococcus multilocularis cpg binding protein 0.0029 0.005 0.0052
Loa Loa (eye worm) hypothetical protein 0.0165 0.0438 0.0468
Treponema pallidum recombinase A 0.0112 0.0285 0.129
Schistosoma mansoni hypothetical protein 0.034 0.0936 0.1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0046 0.0049
Leishmania major hypothetical protein, conserved 0.0024 0.0036 0.0779
Schistosoma mansoni rab6-interacting 0.002 0.0024 0.0024
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0044 0.0047
Trypanosoma brucei Heat shock protein 83, putative 0.0044 0.0092 0.2085
Entamoeba histolytica hypothetical protein 0.0072 0.0172 0.104
Brugia malayi Cell death protein 3 precursor 0.003 0.0051 0.0055
Trypanosoma cruzi heat shock protein 90, putative 0.0038 0.0074 0.1666
Echinococcus multilocularis apoptotic protease activating factor 1 0.003 0.0051 0.0053
Echinococcus granulosus sterol regulatory element binding protein 0.0153 0.0402 0.0429
Loa Loa (eye worm) hypothetical protein 0.0299 0.0821 0.0878
Loa Loa (eye worm) hypothetical protein 0.0013 0.0003 0.0003
Loa Loa (eye worm) acetyltransferase 0.015 0.0395 0.0422
Leishmania major heat shock protein, putative 0.0029 0.005 0.1111
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0016 0.0012 0.0012
Trichomonas vaginalis heat shock protein, putative 0.0044 0.0092 0.0556
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0141 0.0149
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.015 0.0395 0.0421
Onchocerca volvulus 0.0037 0.0072 0.2204
Brugia malayi MH2 domain containing protein 0.0239 0.0649 0.0695
Brugia malayi Hsp90 protein 0.0029 0.005 0.0053
Echinococcus granulosus intermediate filament protein 0.0028 0.0046 0.0047
Toxoplasma gondii ABC1 family protein 0.0037 0.0072 0.1624
Schistosoma mansoni hypothetical protein 0.0072 0.0172 0.0182
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0009 0.0184
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.0092 0.0097
Schistosoma mansoni hypothetical protein 0.0016 0.0013 0.0012
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0024 0.0024
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.0036 0.0779
Schistosoma mansoni lamin 0.0028 0.0046 0.0047
Plasmodium vivax multidomain scavenger receptor, putative 0.002 0.0024 0.0543
Brugia malayi RNA binding protein 0.0061 0.0141 0.0151
Brugia malayi hypothetical protein 0.0016 0.0011 0.0012
Loa Loa (eye worm) hypothetical protein 0.0197 0.0529 0.0566
Plasmodium vivax heat shock protein, putative 0.0168 0.0446 1
Chlamydia trachomatis recombinase RecA 0.0112 0.0285 0.256
Loa Loa (eye worm) twinkle helicase 0.0114 0.0293 0.0313
Trypanosoma cruzi heat shock protein 85, putative 0.0044 0.0092 0.2085
Trypanosoma cruzi heat shock protein, putative 0.0029 0.005 0.1111
Entamoeba histolytica heat shock protein 90, putative 0.0044 0.0092 0.0556
Brugia malayi MH1 domain containing protein 0.0016 0.0012 0.0013
Onchocerca volvulus 0.0028 0.0046 0.139
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0024 0.0024
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0072 0.0172 0.0182
Entamoeba histolytica heat shock protein 90, putative 0.0044 0.0092 0.0556
Echinococcus granulosus heat shock protein 90 0.0044 0.0092 0.0097
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0113 0.0121
Onchocerca volvulus 0.003 0.0051 0.156
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0013 0.0012
Brugia malayi hypothetical protein 0.0024 0.0036 0.0038
Echinococcus granulosus RUN 0.002 0.0024 0.0024
Chlamydia trachomatis replicative DNA helicase 0.04 0.111 1
Brugia malayi Peroxidasin 0.0027 0.0044 0.0047
Brugia malayi Smad1 0.0016 0.0012 0.0013
Echinococcus granulosus smad 0.0016 0.0012 0.0012
Echinococcus granulosus dnaJ subfamily B 0.0396 0.1097 0.1172
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Schistosoma mansoni heat shock protein 0.0044 0.0092 0.0097
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Echinococcus multilocularis Polycystic kidney disease protein 0.002 0.0024 0.0024
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0009 0.0009
Echinococcus granulosus heat shock protein 90 0.0038 0.0074 0.0078
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0009 0.0213
Brugia malayi Endoplasmin precursor 0.0044 0.0092 0.0099
Trypanosoma brucei heat shock protein 90, putative 0.0044 0.0092 0.2085
Onchocerca volvulus Peroxidase homolog 0.0027 0.0044 0.1329
Brugia malayi Doublecortin family protein 0.002 0.0024 0.0026
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.0072 0.0077
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0072 0.0076
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0072 0.0172 0.0182
Schistosoma mansoni hypothetical protein 0.3284 0.9349 1
Echinococcus multilocularis lamin 0.0028 0.0046 0.0047
Trichomonas vaginalis conserved hypothetical protein 0.0153 0.0402 0.2446
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0013 0.0012
Brugia malayi MH1 domain containing protein 0.0016 0.0012 0.0013
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0046 0.0049
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0072 0.0433
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Toxoplasma gondii heat shock protein 75, putative 0.0029 0.005 0.1121
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.0141 0.0151
Echinococcus granulosus expressed conserved protein 0.0185 0.0495 0.0528
Schistosoma mansoni peroxidasin 0.0027 0.0044 0.0045
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Plasmodium falciparum heat shock protein 90, putative 0.0026 0.0039 0.0885
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Wolbachia endosymbiont of Brugia malayi recombinase A 0.0112 0.0285 0.1957
Echinococcus granulosus caspase 2 0.003 0.0051 0.0053
Echinococcus multilocularis heat shock protein 90 0.0044 0.0092 0.0097
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0586 0.1639 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.0263 0.0281
Schistosoma mansoni hypothetical protein 0.0082 0.0199 0.0211
Trypanosoma cruzi DNA repair protein, putative 0.0034 0.0064 0.1436
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0165 0.0438 0.0467
Schistosoma mansoni Smad4 0.0016 0.0012 0.0012
Mycobacterium ulcerans replicative DNA helicase DnaB 0.04 0.111 1
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0141 0.0149
Loa Loa (eye worm) endoplasmin 0.0044 0.0092 0.0099
Plasmodium falciparum heat shock protein 90 0.0044 0.0092 0.2074
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0009 0.0184
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0037 0.0072 0.0063
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Schistosoma mansoni endoplasmin 0.0044 0.0092 0.0097
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0113 0.0121
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0029 0.005 0.0052
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0036 0.0779
Onchocerca volvulus Peroxidase homolog 0.0027 0.0044 0.1329
Schistosoma mansoni cpg binding protein 0.0029 0.005 0.0052
Echinococcus granulosus TGF beta signal transducer SmadC 0.0016 0.0012 0.0012
Echinococcus multilocularis geminin 0.034 0.0936 0.1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Trypanosoma brucei heat shock protein 84, putative 0.0029 0.005 0.1111
Loa Loa (eye worm) hypothetical protein 0.002 0.0024 0.0026
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0064 0.0149 0.0903
Onchocerca volvulus Dual oxidase homolog 0.0027 0.0044 0.1329
Onchocerca volvulus Peroxidasin homolog 0.0027 0.0044 0.1329
Schistosoma mansoni microtubule-associated protein tau 0.0715 0.2009 0.2148
Loa Loa (eye worm) Ulp1 protease 0.0064 0.0149 0.016
Echinococcus granulosus mothers against decapentaplegic 5 0.0016 0.0012 0.0012
Echinococcus multilocularis indoleamine 2,3 dioxygenase 2 0.3284 0.9349 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0027 0.0044 0.0047
Plasmodium vivax heat shock protein 90, putative 0.0029 0.005 0.1121
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0042 0.0085 0.1907
Plasmodium vivax sentrin-specific protease 1, putative 0.0012 0.0001 0.0033
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0013 0.0012
Schistosoma mansoni hypothetical protein 0.0016 0.0013 0.0012
Echinococcus granulosus indoleamine 23 dioxygenase 2 0.3284 0.9349 1
Echinococcus multilocularis endoplasmin 0.0042 0.0085 0.0089
Echinococcus granulosus Niemann Pick C1 protein 0.035 0.0966 0.1032
Echinococcus multilocularis Smad4 0.0016 0.0012 0.0012
Echinococcus multilocularis GPCR, family 2 0.0016 0.0013 0.0012
Brugia malayi Blistered cuticle protein 3 0.0027 0.0044 0.0047
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0078 0.0187 0.1135
Echinococcus granulosus lamin 0.0028 0.0046 0.0047
Echinococcus multilocularis Niemann Pick C1 protein 0.0197 0.0529 0.0565
Schistosoma mansoni hypothetical protein 0.0016 0.0013 0.0012
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0013 0.0013
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.0072 0.0076
Loa Loa (eye worm) hypothetical protein 0.0052 0.0113 0.0121
Loa Loa (eye worm) RNA binding protein 0.0061 0.0141 0.0151
Mycobacterium leprae PROBABLE REPLICATIVE DNA HELICASE DNAB replicative DNA helicase 0.04 0.111 0.3176
Brugia malayi Muscleblind-like protein 0.0299 0.0821 0.0878
Echinococcus granulosus cpg binding protein 0.0029 0.005 0.0052
Toxoplasma gondii isocitrate dehydrogenase 0.0015 0.0009 0.0213
Mycobacterium tuberculosis Probable lipase LipE 0.0037 0.0072 0.0063
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0197 0.0529 0.3224
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0044 0.0047
Loa Loa (eye worm) transcription factor SMAD2 0.0239 0.0649 0.0695
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.0072 0.0076
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0134 0.0142
Echinococcus multilocularis lipoxygenase domain containing protein 0.002 0.0024 0.0024
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Brugia malayi isocitrate dehydrogenase 0.0015 0.0009 0.001
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0072 0.0433
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0165 0.0438 0.0467
Schistosoma mansoni peroxidasin 0.0027 0.0044 0.0045
Echinococcus granulosus lamin dm0 0.0028 0.0046 0.0047
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0012 0.0001 0.0033
Trypanosoma cruzi heat shock protein 85, putative 0.0044 0.0092 0.2085
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.0141 0.0151
Trichomonas vaginalis heat shock protein, putative 0.0042 0.0085 0.0508
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0072 0.0076
Echinococcus granulosus histone acetyltransferase KAT2B 0.0146 0.0383 0.0408
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0009 0.0184
Echinococcus multilocularis mothers against decapentaplegic 5 0.0016 0.0012 0.0012
Brugia malayi TAR-binding protein 0.0061 0.0141 0.0151
Loa Loa (eye worm) Smad1 0.0016 0.0012 0.0013
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Schistosoma mansoni endoplasmin 0.0044 0.0092 0.0097
Trypanosoma cruzi heat shock protein 90, putative 0.0044 0.0092 0.2085
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0153 0.0402 0.043
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Trypanosoma brucei hypothetical protein, conserved 0.0037 0.0072 0.1625
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0113 0.0121
Schistosoma mansoni Replicative DNA helicase 0.04 0.111 0.1186
Mycobacterium tuberculosis Probable esterase LipL 0.0037 0.0072 0.0063
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0072 0.1625
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0165 0.0438 0.0467
Trypanosoma cruzi DNA repair protein, putative 0.0034 0.0064 0.1436
Treponema pallidum replicative DNA helicase (dnaB) 0.04 0.111 0.6596
Trichomonas vaginalis heat shock protein, putative 0.0032 0.0058 0.0344
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0165 0.0438 1
Schistosoma mansoni smad1 5 8 and 0.0016 0.0012 0.0012
Plasmodium falciparum LCCL domain-containing protein 0.002 0.0024 0.0543
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0013 0.0012
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0141 0.0149
Loa Loa (eye worm) TAR-binding protein 0.0061 0.0141 0.0151
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0012 0.0001 0.0002
Brugia malayi Niemann-Pick C1 protein precursor 0.0197 0.0529 0.0566
Echinococcus granulosus Niemann Pick C1 protein 0.0197 0.0529 0.0565
Toxoplasma gondii heat shock protein 90, putative 0.0044 0.0092 0.2074
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0044 0.0047
Trichomonas vaginalis esterase, putative 0.0037 0.0072 0.0433
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Schistosoma mansoni lipoxygenase 0.0085 0.021 0.0223
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0078 0.0187 0.1135
Plasmodium vivax hypothetical protein, conserved 0.0037 0.0072 0.1624
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0286 0.0783 0.2176
Mycobacterium leprae RECA PROTEIN (RECOMBINASE A) [CONTAINS: Mle RECA INTEIN]. 0.0112 0.0285 0.0652
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0141 0.0149
Loa Loa (eye worm) heat shock protein 75 0.0029 0.005 0.0053
Schistosoma mansoni smad1 5 8 and 0.0016 0.0012 0.0012
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0012 0.0001 0.0002
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.0262 0.028
Schistosoma mansoni smad 0.0016 0.0012 0.0012
Entamoeba histolytica hypothetical protein 0.0072 0.0172 0.104
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0064 0.0149 0.0903
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0044 0.0047
Onchocerca volvulus 0.0027 0.0044 0.1329
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0012 0.0001 0.0002
Plasmodium falciparum heat shock protein 90, putative 0.0168 0.0446 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0051 0.0055
Echinococcus multilocularis lamin dm0 0.0028 0.0046 0.0047
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0165 0.0438 1
Echinococcus granulosus apoptotic protease activating factor 1 0.003 0.0051 0.0053
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0037 0.0072 0.0063
Schistosoma mansoni hypothetical protein 0.3284 0.9349 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0239 0.0649 0.0695
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0044 0.0047
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Brugia malayi MH2 domain containing protein 0.0016 0.0012 0.0013
Plasmodium falciparum sentrin-specific protease 1 0.0012 0.0001 0.0033
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.0092 0.2064
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0165 0.0438 1
Onchocerca volvulus 0.002 0.0024 0.0736
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.0082 0.0489
Brugia malayi hypothetical protein 0.0127 0.0329 0.0351
Trypanosoma cruzi heat shock protein 90, putative 0.0019 0.0019 0.0398
Schistosoma mansoni lamin 0.0028 0.0046 0.0047
Echinococcus multilocularis peroxidasin 0.0027 0.0044 0.0045
Mycobacterium tuberculosis RecA protein (recombinase A) [contains: endonuclease PI-MTUI (MTU RecA intein)]. 0.3223 0.9175 0.9175
Echinococcus multilocularis heat shock protein 90 0.0038 0.0074 0.0078
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.0092 0.0553
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0042 0.0085 0.0075
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Trichomonas vaginalis endoplasmin, putative 0.0032 0.0058 0.0344
Schistosoma mansoni hypothetical protein 0.003 0.0051 0.0053
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0013 0.0013
Schistosoma mansoni transcription factor LCR-F1 0.0072 0.0172 0.0182
Schistosoma mansoni hypothetical protein 0.0082 0.0199 0.0211
Onchocerca volvulus Huntingtin homolog 0.0127 0.0329 1
Echinococcus multilocularis tar DNA binding protein 0.0061 0.0141 0.0149
Onchocerca volvulus Huntingtin homolog 0.0127 0.0329 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0016 0.0012 0.0012
Echinococcus granulosus muscleblind protein 0.0299 0.0821 0.0877
Brugia malayi CXXC zinc finger family protein 0.0028 0.0045 0.0048
Onchocerca volvulus 0.0028 0.0045 0.1376
Echinococcus multilocularis microtubule associated protein 2 0.0715 0.2009 0.2148
Brugia malayi MH2 domain containing protein 0.0016 0.0012 0.0013
Echinococcus multilocularis dnaJ subfamily B 0.0396 0.1097 0.1172
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0012 0.0001 0.0033
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0165 0.0438 0.0468
Plasmodium vivax sentrin-specific protease 2, putative 0.0012 0.0001 0.0033
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0122 0.0315 0.0335
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.0036 0.0796
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0036 0.0779
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0009 0.0009
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0009 0.0009
Onchocerca volvulus 0.002 0.0024 0.0736
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0009 0.0009
Schistosoma mansoni hypothetical protein 0.002 0.0024 0.0024
Onchocerca volvulus 0.0028 0.0046 0.139
Echinococcus multilocularis protein dispatched 1 0.0165 0.0436 0.0465
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0009 0.001
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0013 0.0004 0.0003
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0009 0.0009
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0012 0.0013
Schistosoma mansoni lipoxygenase 0.0122 0.0315 0.0335
Plasmodium falciparum endoplasmin, putative 0.0032 0.0058 0.1295
Loa Loa (eye worm) hypothetical protein 0.0127 0.0329 0.0351
Mycobacterium ulcerans heat shock protein 90 0.0042 0.0085 0.0118
Loa Loa (eye worm) hypothetical protein 0.002 0.0024 0.0026
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0046 0.0049
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.0092 0.2064
Giardia lamblia Grp94/Hsp90 0.0042 0.0085 0.0508
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Schistosoma mansoni cpg binding protein 0.0029 0.005 0.0052
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0036 0.0796
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.0082 0.1828
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Loa Loa (eye worm) hypothetical protein 0.0035 0.0067 0.0071
Echinococcus granulosus geminin 0.034 0.0936 0.1
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0268 0.0733 0.0782
Mycobacterium tuberculosis Probable hydrolase 0.0037 0.0072 0.0063
Loa Loa (eye worm) hypothetical protein 0.0024 0.0036 0.0038
Echinococcus multilocularis expressed conserved protein 0.0185 0.0495 0.0528
Schistosoma mansoni hypothetical protein 0.0035 0.0067 0.007
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0072 0.0433
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Brugia malayi indoleamine 2,3-dioxygenase 0.3284 0.9349 1
Onchocerca volvulus Peroxidasin homolog 0.0027 0.0044 0.1329
Schistosoma mansoni hypothetical protein 0.0396 0.1097 0.1172
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Onchocerca volvulus 0.0037 0.0072 0.2204
Echinococcus multilocularis sentrin specific protease 8 0.0064 0.0149 0.0158
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0015 0.0009 0.0213
Trypanosoma cruzi Heat shock protein 83, putative 0.0044 0.0092 0.2085
Onchocerca volvulus 0.0027 0.0044 0.1329
Onchocerca volvulus 0.0012 0.0001 0.0045
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0045 0.0048
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0072 0.0433
Trypanosoma brucei heat shock protein 90, putative 0.0044 0.0092 0.2085
Brugia malayi beta-lactamase family protein 0.0037 0.0072 0.0077
Echinococcus granulosus transcription factor eb 0.0104 0.0264 0.0281
Trypanosoma brucei recA bacterial DNA recombination protein, putative 0.0034 0.0064 0.1436
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Loa Loa (eye worm) hypothetical protein 0.0012 0.0001 0.0002
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.015 0.0395 0.0421
Trichomonas vaginalis heat shock protein, putative 0.0042 0.0085 0.0508
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.1625 0.4609 0.4929
Loa Loa (eye worm) hypothetical protein 0.0299 0.0821 0.0878
Mycobacterium tuberculosis Probable lipase LipD 0.0037 0.0072 0.0063
Mycobacterium tuberculosis Conserved protein 0.0037 0.0072 0.0063
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0012 0.0013
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0029 0.005 0.0052
Wolbachia endosymbiont of Brugia malayi replicative DNA helicase 0.04 0.111 1
Schistosoma mansoni caspase-7 (C14 family) 0.003 0.0051 0.0053
Trypanosoma cruzi hypothetical protein 0.0064 0.0149 0.3389
Loa Loa (eye worm) indoleamine 2,3-dioxygenase 0.3284 0.9349 1
Echinococcus granulosus endoplasmin 0.0042 0.0085 0.0089
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Schistosoma mansoni loxhd1 0.002 0.0024 0.0024
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0286 0.0783 0.0774
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0064 0.0149 0.0903
Echinococcus multilocularis RUN 0.002 0.0024 0.0024
Echinococcus multilocularis heat shock protein 0.0044 0.0092 0.0097
Entamoeba histolytica hypothetical protein 0.0072 0.0172 0.104
Brugia malayi hypothetical protein 0.002 0.0024 0.0026
Toxoplasma gondii heat shock protein HSP90 0.0044 0.0092 0.2074
Loa Loa (eye worm) Ulp1 protease 0.0012 0.0001 0.0002
Echinococcus multilocularis protein patched 0.0153 0.0402 0.0429
Echinococcus granulosus lipoxygenase domain containing protein 0.002 0.0024 0.0024
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0286 0.0783 0.6851
Brugia malayi hypothetical protein 0.0027 0.0044 0.0047
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Mycobacterium tuberculosis Conserved protein 0.0037 0.0072 0.0063
Schistosoma mansoni hypothetical protein 0.0082 0.0199 0.0211
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0067 0.0071
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Loa Loa (eye worm) beta-lactamase 0.0037 0.0072 0.0077
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0064 0.0149 0.0903
Loa Loa (eye worm) hypothetical protein 0.0012 0.0001 0.0002
Loa Loa (eye worm) helix-loop-helix DNA-binding domain-containing protein 0.0104 0.0263 0.0281
Giardia lamblia Histone acetyltransferase GCN5 0.004 0.0082 0.0489
Brugia malayi beta-lactamase 0.0037 0.0072 0.0077
Loa Loa (eye worm) hypothetical protein 0.0012 0.0001 0.0002
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Echinococcus granulosus sentrin specific protease 8 0.0064 0.0149 0.0158
Echinococcus granulosus tar DNA binding protein 0.0061 0.0141 0.0149
Trichomonas vaginalis heat shock protein, putative 0.0026 0.0039 0.0232
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0029 0.005 0.0296
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Echinococcus granulosus heat shock protein 0.0044 0.0092 0.0097
Mycobacterium ulcerans recombinase A 0.0112 0.0285 0.2052
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0009 0.0184
Brugia malayi heat shock protein 90 0.0044 0.0092 0.0099
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0013 0.0013
Brugia malayi acetyltransferase, GNAT family protein 0.015 0.0395 0.0422
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0586 0.1639 1
Mycobacterium leprae Conserved hypothetical protein 0.1181 0.3339 1
Loa Loa (eye worm) hypothetical protein 0.0127 0.0329 0.0351
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0036 0.0796
Echinococcus multilocularis sterol regulatory element binding protein 0.0153 0.0402 0.0429
Loa Loa (eye worm) heat shock protein 90 0.0044 0.0092 0.0099
Schistosoma mansoni rab6-interacting 0.002 0.0024 0.0024
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Brugia malayi hypothetical protein 0.0072 0.0172 0.0184
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Schistosoma mansoni intermediate filament proteins 0.0028 0.0046 0.0047
Loa Loa (eye worm) hypothetical protein 0.003 0.0051 0.0055
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Echinococcus multilocularis muscleblind protein 1 0.0299 0.0821 0.0877
Echinococcus multilocularis caspase 2 0.003 0.0051 0.0053
Trichomonas vaginalis heat shock protein, putative 0.0038 0.0074 0.0444
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0044 0.0047
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.0036 0.0796
Loa Loa (eye worm) hypothetical protein 0.0027 0.0044 0.0047
Trichomonas vaginalis Sentrin-specific protease, putative 0.0064 0.0149 0.0903
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0009 0.001
Schistosoma mansoni hypothetical protein 0.034 0.0936 0.1
Brugia malayi Helix-loop-helix DNA-binding domain containing protein 0.0104 0.0264 0.0283
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0586 0.1639 1
Brugia malayi intermediate filament protein 0.0028 0.0046 0.0049
Echinococcus granulosus Polycystic kidney disease protein 0.002 0.0024 0.0024
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0072 0.1625
Schistosoma mansoni heat shock protein 0.0044 0.0092 0.0097
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0.0009 0.0213
Echinococcus granulosus peroxidasin 0.0027 0.0044 0.0045
Trypanosoma brucei heat shock protein, putative 0.0044 0.0092 0.2085
Schistosoma mansoni hypothetical protein 0.0082 0.0199 0.0211
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0009 0.0009
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0012 0.0001 0.0033
Giardia lamblia Heat shock protein HSP 90-alpha 0.0038 0.0074 0.0444
Loa Loa (eye worm) hypothetical protein 0.0013 0.0004 0.0005
Loa Loa (eye worm) doublecortin family protein 0.002 0.0024 0.0026
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0165 0.0438 0.3523
Echinococcus multilocularis muscleblind protein 0.0299 0.0821 0.0877
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0009 0.0009
Schistosoma mansoni tar DNA-binding protein 0.0061 0.0141 0.0149
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0165 0.0438 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0072 0.0077
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0127 0.2843
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0122 0.0315 0.0335
Schistosoma mansoni heat shock protein 0.0029 0.005 0.0052
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.0072 0.0077
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0072 0.0433
Plasmodium vivax heat shock protein 86, putative 0.0044 0.0092 0.2074
Echinococcus multilocularis musashi 0.0028 0.0046 0.0047
Leishmania major heat shock protein 83-1 0.0044 0.0092 0.2085
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.0092 0.2064
Echinococcus granulosus Smad4 0.0016 0.0012 0.0012
Brugia malayi beta-lactamase family protein 0.0037 0.0072 0.0077
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0044 0.0047
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0009 0.0009
Giardia lamblia Fructose-bisphosphate aldolase 0.0586 0.1639 1
Giardia lamblia Heat shock protein HSP 90-alpha 0.0044 0.0092 0.0556
Toxoplasma gondii Hsp90 domain-containing protein 0.0168 0.0446 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 94 nM In vitro inhibition of rat liver HMG-CoA reductase ChEMBL. 2296036

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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