Detailed information for compound 1328098

Basic information

Technical information
  • TDR Targets ID: 1328098
  • Name: 2-(benzotriazol-1-yl)-1-cyclopropylethanone
  • MW: 201.225 | Formula: C11H11N3O
  • H donors: 0 H acceptors: 3 LogP: 1.42 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1CC1)Cn1nnc2c1cccc2
  • InChi: 1S/C11H11N3O/c15-11(8-5-6-8)7-14-10-4-2-1-3-9(10)12-13-14/h1-4,8H,5-7H2
  • InChiKey: FSKWTFJYVNPIJB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(benzotriazol-1-yl)-1-cyclopropyl-ethanone
  • 2-(1-benzotriazolyl)-1-cyclopropylethanone
  • 2-(1H-1,2,3-benzotriazol-1-yl)-1-cyclopropylethanone
  • MLS000090353
  • SMR000024963
  • TimTec1_005578
  • ZINC00076538
  • A1942/0081596
  • EU-0018503

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

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
Loa Loa (eye worm) hypothetical protein 0.0161 0.3464 0.3464
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 1
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.2209 0.359
Schistosoma mansoni carbonic anhydrase-related 0.0161 0.3464 0.3464
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Mycobacterium ulcerans lipase LipD 0.0035 0.0454 0.0737
Schistosoma mansoni DNA helicase recq5 0.0019 0.0054 0.0054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Leishmania major cathepsin L-like protease 0.0063 0.1108 0.1108
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0454 0.08
Plasmodium falciparum DNA repair protein REV1, putative 0.0016 0 0.0001
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0066 0.1187 0.1187
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0056 0.0091
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0226 0.5022 1
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0109 0.2209 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0054 0.0906 0.0906
Mycobacterium leprae Probable lipase LipE 0.0035 0.0454 0.1035
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1187 0.1187
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Leishmania major hypothetical protein, conserved 0.0058 0.0987 0.0987
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0434 1 1
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Echinococcus granulosus histone acetyltransferase KAT2B 0.0141 0.2979 0.2979
Toxoplasma gondii hypothetical protein 0.0027 0.0251 0.0724
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0646 0.0646
Trichomonas vaginalis DNA polymerase eta, putative 0.008 0.1513 0.246
Entamoeba histolytica acetyltransferase, GNAT family 0.0039 0.0541 0.1325
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0056 0.0056
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0192 0.4198 0.4198
Trichomonas vaginalis DNA helicase recq1, putative 0.0045 0.0692 0.1124
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0066 0.1187 0.1187
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1187 0.1187
Schistosoma mansoni peptidase Clp (S14 family) 0.0078 0.1478 0.1478
Echinococcus multilocularis intestinal type alkaline phosphatase 0.0315 0.715 0.715
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0454 0.08
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0029 0.0309 0.1175
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0053 0.0877 0.0877
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0637 0.0637
Brugia malayi Bloom's syndrome protein homolog 0.0045 0.0692 0.0692
Loa Loa (eye worm) RecQ helicase 0.0045 0.0692 0.0692
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0056 0.0091
Brugia malayi beta-lactamase 0.0035 0.0454 0.0454
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0066 0.1187 0.1187
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.006 0.1035 0.197
Leishmania major DNA polymerase kappa, putative 0.006 0.1035 0.1035
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0454 0.0454
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0066 0.1187 0.1187
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0029 0.0309 0.0756
Plasmodium falciparum histone acetyltransferase GCN5 0.0039 0.0541 0.1563
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0054 0.0906 0.0906
Brugia malayi hypothetical protein 0.0043 0.0646 0.0646
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.2209 0.359
Trypanosoma cruzi hypothetical protein, conserved 0.0058 0.0987 0.0987
Loa Loa (eye worm) hypothetical protein 0.0138 0.2907 0.2907
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.1108 0.1108
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0186 0.0302
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0043 0.0626 0.4237
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0031 0.034 0.2299
Leishmania major DNA polymerase eta, putative 0.0042 0.061 0.061
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0454 0.0454
Trypanosoma brucei DNA polymerase eta, putative 0.0079 0.1487 0.1487
Loa Loa (eye worm) glutaminase 2 0.0273 0.6152 0.6152
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0129 0.2704 0.5333
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.2209 0.5407
Echinococcus multilocularis carbonic anhydrase 0.0161 0.3464 0.3464
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0187 0.4085 0.664
Trypanosoma cruzi DNA polymerase kappa, putative 0.008 0.1513 0.1513
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0048 0.0748 0.1831
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0454 0.0737
Loa Loa (eye worm) acetyltransferase 0.0145 0.3077 0.3077
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0056 0.0137
Echinococcus multilocularis carbonic anhydrase 0.0161 0.3464 0.3464
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0454 0.0454
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Echinococcus multilocularis alkaline phosphatase 0.0315 0.715 0.715
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0251 0.0905
Onchocerca volvulus 0.0163 0.3498 0.8563
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0187 0.4085 0.664
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 0.2403
Brugia malayi 6-phosphofructokinase 0.0109 0.2209 0.2209
Entamoeba histolytica hypothetical protein 0.0043 0.0646 0.1581
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0309 0.209
Entamoeba histolytica hypothetical protein 0.0043 0.0646 0.1581
Mycobacterium ulcerans DNA polymerase IV 0.008 0.1513 0.246
Echinococcus multilocularis phosphatidylinositol 5 phosphate 4 kinase type 2 0.0163 0.3498 0.3498
Brugia malayi beta-lactamase family protein 0.0035 0.0454 0.0454
Trypanosoma brucei DNA polymerase IV, putative 0.008 0.1513 0.1513
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.003 0.0331 0.0956
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0056 0.0137
Loa Loa (eye worm) hypothetical protein 0.0054 0.0906 0.0906
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0187 0.4085 1
Brugia malayi phosphofructokinase 0.0109 0.2209 0.2209
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.2209 0.359
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0454 0.0737
Brugia malayi beta-lactamase family protein 0.0035 0.0454 0.0454
Mycobacterium ulcerans beta-lactamase 0.0035 0.0454 0.0737
Echinococcus multilocularis bloom syndrome protein 0.0045 0.0692 0.0692
Schistosoma mansoni hypothetical protein 0.0164 0.3526 0.3526
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0454 0.08
Trypanosoma cruzi DNA polymerase eta, putative 0.0042 0.061 0.061
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0192 0.4198 0.4198
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0078 0.1478 0.627
Loa Loa (eye worm) pip kinase 2 0.0163 0.3498 0.3498
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0521 0.0521
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0078 0.1478 0.1478
Echinococcus multilocularis carbonic anhydrase 0.0161 0.3464 0.3464
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0019 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0078 0.1478 0.1478
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0109 0.2209 0.2209
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0056 0.0056
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0066 0.1187 0.1187
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0053 0.0877 0.0877
Toxoplasma gondii phosphofructokinase PFKII 0.0029 0.0309 0.0892
Schistosoma mansoni ap endonuclease 0.0019 0.0056 0.0056
Schistosoma mansoni carbonic anhydrase-related 0.0161 0.3464 0.3464
Loa Loa (eye worm) MBCTL1 0.0054 0.0906 0.0906
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0051 0.0833 0.2974
Trypanosoma brucei unspecified product 0.0037 0.0482 0.0482
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 1
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.004 0.056 0.1616
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0748 0.0748
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0646 0.0646
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0053 0.0877 0.0877
Schistosoma mansoni alkaline phosphatase 0.0315 0.715 0.715
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1187 0.1186
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0145 0.3077 0.3077
Schistosoma mansoni hypothetical protein 0.0161 0.3464 0.3464
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0078 0.1478 0.1478
Brugia malayi Probable ClpP-like protease 0.0078 0.1478 0.1478
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0161 0.3464 0.3464
Schistosoma mansoni glutaminase 0.0273 0.6152 0.6152
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0043 0.0626 0.1018
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0454 0.3068
Loa Loa (eye worm) glutaminase 0.0273 0.6152 0.6152
Onchocerca volvulus 0.0035 0.0454 0.111
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0161 0.3464 0.3464
Brugia malayi ImpB/MucB/SamB family protein 0.0053 0.0877 0.0877
Echinococcus granulosus dna polymerase kappa 0.008 0.1513 0.1513
Onchocerca volvulus 0.0035 0.0454 0.111
Schistosoma mansoni hypothetical protein 0.0294 0.6641 0.6641
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Mycobacterium tuberculosis Conserved hypothetical protein 0.0053 0.0877 0.1652
Brugia malayi glutaminase DH11.1 0.0273 0.6152 0.6152
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.1108 0.1108
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 0.2403
Echinococcus granulosus histone acetyltransferase KAT2B 0.0043 0.0626 0.0626
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0019 0.0054 0.0054
Schistosoma mansoni DNA helicase recq1 0.0019 0.0054 0.0054
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0161 0.3464 0.3464
Echinococcus granulosus alkaline phosphatase 0.0315 0.715 0.715
Echinococcus granulosus 6 phosphofructokinase 0.0109 0.2209 0.2209
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0454 0.0737
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0187 0.4085 0.664
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0186 0.0186
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0454 0.0737
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0454 0.0454
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0066 0.1187 0.2905
Entamoeba histolytica recQ family helicase, putative 0.0024 0.0186 0.0455
Loa Loa (eye worm) hypothetical protein 0.0019 0.0054 0.0054
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0043 0.0626 0.1808
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0454 0.0454
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0186 0.0186
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0054 0.0156
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0434 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0454 0.0737
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0019 0.0054 0.0054
Echinococcus granulosus polycomb protein SCMH1 0.0048 0.0748 0.0748
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0434 1 1
Loa Loa (eye worm) mbt repeat family protein 0.0048 0.0748 0.0748
Loa Loa (eye worm) hypothetical protein 0.0079 0.1487 0.1487
Brugia malayi ImpB/MucB/SamB family protein 0.0079 0.1487 0.1487
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0056 0.0056
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0434 1 1
Toxoplasma gondii hypothetical protein 0.0161 0.3464 1
Schistosoma mansoni ap endonuclease 0.0019 0.0056 0.0056
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0309 0.0892
Echinococcus multilocularis dna polymerase kappa 0.008 0.1513 0.1513
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0454 0.08
Trypanosoma brucei unspecified product 0.0073 0.1355 0.1355
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0187 0.4085 0.664
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0434 1 1
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0187 0.4085 1
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0187 0.4085 0.664
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0029 0.0309 0.0892
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0309 0.0892
Schistosoma mansoni carbonic anhydrase-related 0.0161 0.3464 0.3464
Brugia malayi mbt repeat family protein 0.0048 0.0748 0.0748
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.008 0.1513 0.246
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0078 0.1478 1
Schistosoma mansoni 6-phosphofructokinase 0.0109 0.2209 0.2209
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0109 0.2209 0.2209
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0161 0.3464 0.3464
Toxoplasma gondii 6-phosphofructokinase 0.0029 0.0309 0.0892
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.2209 0.359
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0054 0.0054
Schistosoma mansoni terminal deoxycytidyl transferase 0.0053 0.0877 0.0877
Plasmodium vivax DNA repair protein REV1, putative 0.0016 0 0.0001
Echinococcus granulosus SAM and MBT domain containing protein 0.0048 0.0748 0.0748
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0454 0.0454
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0109 0.2209 0.4335
Brugia malayi mbt repeat family protein 0.0048 0.0748 0.0748
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0056 0.0162
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0454 0.0453
Entamoeba histolytica deoxycytidyl transferase, putative 0.0053 0.0877 0.2146
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.2209 0.5407
Loa Loa (eye worm) hypothetical protein 0.0161 0.3464 0.3464
Mycobacterium tuberculosis Conserved protein 0.0035 0.0454 0.08
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0016 0 0.0001
Toxoplasma gondii ABC1 family protein 0.0035 0.0454 0.1309
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0056 0.0056
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0053 0.0877 0.0877
Leishmania major carbonic anhydrase-like protein 0.0434 1 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0027 0.0251 0.1697
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0187 0.4085 0.4085
Echinococcus multilocularis SAM and MBT domain containing protein 0.0048 0.0748 0.0748
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0454 0.0737
Schistosoma mansoni blooms syndrome DNA helicase 0.0036 0.0463 0.0463
Onchocerca volvulus 0.0035 0.0454 0.111
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0019 0.0054 0.0054
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.0187 0.4085 0.4085
Brugia malayi Pip kinase protein 2 0.0163 0.3498 0.3498
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0163 0.3498 0.3498
Entamoeba histolytica hypothetical protein 0.0043 0.0646 0.1581
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.2209 0.5407
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0454 0.08
Echinococcus multilocularis alkaline phosphatase, intestinal, gene 2 0.0315 0.715 0.715
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 1
Giardia lamblia Sgs1 DNA helicase, putative 0.0019 0.0054 0.0132
Giardia lamblia Histone acetyltransferase GCN5 0.0039 0.0541 0.1325
Echinococcus granulosus carbonic anhydrase 0.0161 0.3464 0.3464
Echinococcus granulosus carbonic anhydrase 0.0161 0.3464 0.3464
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0058 0.0987 0.1604
Mycobacterium ulcerans DNA polymerase IV 0.008 0.1513 0.246
Echinococcus granulosus alkaline phosphatase intestinal gene 2 0.0315 0.715 0.715
Trypanosoma cruzi DNA polymerase kappa, putative 0.008 0.1513 0.1513
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0251 0.0724
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0056 0.0379
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0454 0.0454
Leishmania major cathepsin L-like protease 0.0063 0.1108 0.1108
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0161 0.3464 0.3464
Loa Loa (eye worm) 6-phosphofructokinase 0.0109 0.2209 0.2209
Schistosoma mansoni DNA polymerase eta 0.0079 0.1487 0.1487
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Loa Loa (eye worm) hypothetical protein 0.0163 0.3498 0.3498
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0056 0.0056
Loa Loa (eye worm) carbonic anhydrase 3 0.0434 1 1
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0161 0.3464 0.3464
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0058 0.0987 0.1604
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0054 0.0906 0.0906
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0454 0.08
Loa Loa (eye worm) hypothetical protein 0.0161 0.3464 0.3464
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0043 0.0626 0.1808
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0019 0.0054 0.0054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0048 0.0748 0.0748
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0454 0.0454
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Trichomonas vaginalis DNA helicase recq, putative 0.0045 0.0692 0.1124
Echinococcus granulosus intestinal type alkaline phosphatase 0.0315 0.715 0.715
Mycobacterium tuberculosis Conserved protein 0.0035 0.0454 0.08
Mycobacterium ulcerans 6-phosphofructokinase 0.0109 0.2209 0.359
Loa Loa (eye worm) hypothetical protein 0.0048 0.0748 0.0748
Echinococcus multilocularis carbonic anhydrase II 0.0434 1 1
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0023 0.0158 0.0457
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0029 0.0309 0.0502
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0145 0.3077 0.3077
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.1108 0.1108
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0109 0.2209 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0054 0.0906 0.0906
Loa Loa (eye worm) 6-phosphofructokinase 0.0109 0.2209 0.2209
Schistosoma mansoni 6-phosphofructokinase 0.0109 0.2209 0.2209
Trypanosoma brucei carbonic anhydrase-like protein 0.0434 1 1
Echinococcus granulosus intestinal type alkaline phosphatase 1 0.0315 0.715 0.715
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0187 0.4085 1
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Echinococcus multilocularis intestinal type alkaline phosphatase 1 0.0315 0.715 0.715
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0056 0.0091
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0054 0.0054
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0056 0.0056
Echinococcus multilocularis dna polymerase eta 0.0079 0.1487 0.1487
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0309 0.209
Trypanosoma cruzi DNA polymerase kappa, putative 0.008 0.1513 0.1513
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Trypanosoma brucei DNA polymerase kappa, putative 0.006 0.1035 0.1034
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0187 0.4085 0.664
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0051 0.0833 0.1565
Loa Loa (eye worm) hypothetical protein 0.0043 0.0637 0.0637
Mycobacterium ulcerans hypothetical protein 0.0035 0.0454 0.0737
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0029 0.0309 0.0756
Giardia lamblia DINP protein human, muc B family 0.006 0.1035 0.2532
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0454 0.1035
Trypanosoma brucei DNA polymerase kappa, putative 0.008 0.1513 0.1513
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.1108 0.1108
Echinococcus granulosus bloom syndrome protein 0.0045 0.0692 0.0692
Leishmania major cathepsin L-like protease 0.0063 0.1108 0.1108
Brugia malayi polk-prov protein 0.0043 0.0637 0.0637
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0056 0.0056
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0051 0.0833 0.1565
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.0637 0.0637
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0646 0.0646
Trypanosoma brucei DNA polymerase IV, putative 0.0073 0.1355 0.1355
Loa Loa (eye worm) beta-lactamase 0.0035 0.0454 0.0454
Loa Loa (eye worm) phosphofructokinase 0.0109 0.2209 0.2209
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0054 0.0156
Plasmodium falciparum carbonic anhydrase 0.0161 0.3464 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.1108 0.1108
Schistosoma mansoni alkaline phosphatase 0.0315 0.715 0.715
Echinococcus granulosus peptidase Clp S14 family 0.0051 0.0833 0.0833
Entamoeba histolytica hypothetical protein 0.0043 0.0646 0.1581
Trypanosoma cruzi hypothetical protein, conserved 0.0058 0.0987 0.0987
Onchocerca volvulus 0.0187 0.4085 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 0.6607
Schistosoma mansoni carbonic anhydrase 0.0161 0.3464 0.3464
Echinococcus granulosus carbonic anhydrase 0.0161 0.3464 0.3464
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.064 0.064
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Mycobacterium tuberculosis Conserved protein 0.0035 0.0454 0.08
Echinococcus granulosus histone acetyltransferase MYST2 0.0054 0.0906 0.0906
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.064 0.064
Brugia malayi 6-phosphofructokinase 0.0109 0.2209 0.2209
Loa Loa (eye worm) hypothetical protein 0.0035 0.0454 0.0454
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.0978 0.0978
Leishmania major DNA polymerase eta, putative 0.0079 0.1487 0.1487
Trypanosoma cruzi major cysteine proteinase, putative 0.0049 0.0786 0.0786
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0024 0.0186 0.0186
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0454 0.0737
Mycobacterium ulcerans glutaminase 0.0273 0.6152 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0078 0.1478 0.4268
Trichomonas vaginalis esterase, putative 0.0035 0.0454 0.0737
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0187 0.4085 0.664
Echinococcus granulosus carbonic anhydrase II 0.0434 1 1
Echinococcus multilocularis 6 phosphofructokinase 0.0109 0.2209 0.2209
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0309 0.0502
Schistosoma mansoni sex comb on midleg homolog 0.0048 0.0748 0.0748
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0521 0.0521
Trypanosoma brucei unspecified product 0.0037 0.0482 0.0482
Echinococcus granulosus phosphatidylinositol 5 phosphate 4 kinase type 2 0.0163 0.3498 0.3498
Toxoplasma gondii exonuclease III APE 0.0019 0.0056 0.0162
Echinococcus multilocularis peptidase Clp (S14 family) 0.0051 0.0833 0.0833
Schistosoma mansoni phosphatidylinositol-4-phosphate 5-kinase type II 0.0163 0.3498 0.3498
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0434 1 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0066 0.1187 0.1187
Onchocerca volvulus 0.0048 0.0748 0.1831
Brugia malayi acetyltransferase, GNAT family protein 0.0145 0.3077 0.3077
Echinococcus granulosus dna polymerase eta 0.0079 0.1487 0.1487
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0058 0.0987 0.0986
Trypanosoma cruzi DNA polymerase kappa, putative 0.008 0.1513 0.1513
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.006 0.1035 0.1035
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.1478 0.4268
Trypanosoma brucei DNA polymerase kappa, putative 0.0043 0.064 0.064
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0056 0.0056
Echinococcus multilocularis polycomb protein SCMH1 0.0048 0.0748 0.0748
Trichomonas vaginalis bromodomain-containing protein, putative 0.0043 0.0626 0.1018
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.1478 0.4268
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0019 0.0054 0.0156
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0454 0.08
Echinococcus multilocularis histone acetyltransferase MYST2 0.0054 0.0906 0.0906
Schistosoma mansoni hypothetical protein 0.0043 0.0646 0.0646
Trypanosoma brucei DNA polymerase IV, putative 0.008 0.1513 0.1513
Leishmania major hypothetical protein, conserved 0.0035 0.0454 0.0454
Leishmania major ATP-dependent phosphofructokinase 0.0109 0.2209 0.2209
Trypanosoma cruzi DNA polymerase eta, putative 0.0079 0.1487 0.1487
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0042 0.061 0.1762
Trichomonas vaginalis glutaminase, putative 0.0273 0.6152 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2936 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 5.1735 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) = 56.2341 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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