Detailed information for compound 1561336

Basic information

Technical information
  • TDR Targets ID: 1561336
  • Name: 4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl] -3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimi dine
  • MW: 423.871 | Formula: C22H19ClFN5O
  • H donors: 0 H acceptors: 3 LogP: 5.12 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)c1noc2c1c(ncn2)N1CCN(CC1)c1cc(Cl)ccc1C
  • InChi: 1S/C22H19ClFN5O/c1-14-2-5-16(23)12-18(14)28-8-10-29(11-9-28)21-19-20(15-3-6-17(24)7-4-15)27-30-22(19)26-13-25-21/h2-7,12-13H,8-11H2,1H3
  • InChiKey: CYMSLWUILFGEKX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(4-fluorophenyl)isoxazolo[5,4-d]pyrimidine
  • 4-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-(4-fluorophenyl)isoxazolo[5,4-d]pyrimidine
  • 4-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(4-fluorophenyl)-[1,2]oxazolo[5,4-d]pyrimidine
  • NCGC00126261-01
  • E899-0150

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
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0266 0.0972 0.4076
Trypanosoma brucei Aminopeptidase M1, putative 0.0554 0.209 1
Echinococcus granulosus Ankyrin 0.0016 0.0002 0.0001
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0554 0.209 1
Echinococcus granulosus lamin 0.003 0.0054 0.0056
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0027 0.0043 0.0064
Schistosoma mansoni hypothetical protein 0.0063 0.0182 0.019
Plasmodium vivax flap endonuclease 1, putative 0.0029 0.0052 0.0051
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0029 0.0052 0.0052
Trichomonas vaginalis mercuric reductase, putative 0.0036 0.008 0.0293
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0229 0.083 0.087
Toxoplasma gondii phosphofructokinase PFKII 0.0033 0.0066 0.0066
Brugia malayi hypothetical protein 0.1717 0.661 1
Entamoeba histolytica phosphofructokinase, putative 0.0121 0.041 0.1887
Giardia lamblia Flap structure-specific endonuclease 0.0029 0.0052 0.5338
Echinococcus multilocularis leucyl aminopeptidase 0.0092 0.0297 0.031
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0071 0.0215 0.0946
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0024 0.0031 0.005
Loa Loa (eye worm) hypothetical protein 0.0071 0.0215 0.0225
Toxoplasma gondii 6-phosphofructokinase 0.0033 0.0066 0.0066
Echinococcus granulosus 6 phosphofructokinase 0.0121 0.041 0.0429
Brugia malayi hypothetical protein 0.0063 0.0182 0.0275
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0046 0.0118 0.0123
Brugia malayi Pre-SET motif family protein 0.0033 0.0067 0.01
Echinococcus granulosus caspase 2 0.0063 0.0182 0.019
Mycobacterium tuberculosis Probable aminopeptidase PepB 0.0618 0.234 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0001 0.0001
Brugia malayi Protein kinase domain containing protein 0.0057 0.0162 0.0244
Echinococcus granulosus puromycin sensitive aminopeptidase 0.038 0.1415 0.1484
Echinococcus granulosus leucyl aminopeptidase 0.0092 0.0297 0.031
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0462 0.1735 0.8286
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0554 0.209 1
Plasmodium falciparum M17 leucyl aminopeptidase 0.0462 0.1735 0.1719
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0036 0.008 0.0261
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0071 0.0214 0.0223
Echinococcus granulosus apoptotic protease activating factor 1 0.0063 0.0182 0.019
Echinococcus granulosus thioredoxin glutathione reductase 0.0105 0.0346 0.0362
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.038 0.1415 0.6742
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Brugia malayi glutathione reductase 0.0105 0.0346 0.0523
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0105 0.0346 0.1409
Onchocerca volvulus 0.0554 0.209 0.4951
Mycobacterium ulcerans aminopeptidase N PepN 0.038 0.1415 0.6015
Loa Loa (eye worm) 6-phosphofructokinase 0.0121 0.041 0.043
Loa Loa (eye worm) RecQ helicase 0.0024 0.003 0.0031
Schistosoma mansoni ap endonuclease 0.0021 0.0019 0.0019
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0121 0.041 0.1684
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0029 0.0052 0.0156
Onchocerca volvulus 0.1102 0.4221 1
Loa Loa (eye worm) matrixin family protein 0.0043 0.0107 0.0111
Toxoplasma gondii microneme protein MIC4 0.0016 0.0001 0.0001
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Toxoplasma gondii thioredoxin reductase 0.0105 0.0346 0.0346
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Trichomonas vaginalis phosphofructokinase, putative 0.0121 0.041 0.1887
Loa Loa (eye worm) hypothetical protein 0.0019 0.0015 0.0015
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0069 0.0237
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17, putative 0.0462 0.1735 0.8286
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Brugia malayi hypothetical protein 0.0018 0.001 0.0013
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0057 0.0162 0.0161
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0033 0.0066 0.0047
Leishmania major pyroglutamyl-peptidase I (C15 family) 0.0479 0.1802 0.8609
Echinococcus granulosus tissue type plasminogen activator 0.0057 0.0162 0.0168
Leishmania major ATP-dependent phosphofructokinase 0.0121 0.041 0.1887
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Brugia malayi Matrixin family protein 0.0019 0.0015 0.0021
Brugia malayi hypothetical protein 0.0028 0.0048 0.0072
Treponema pallidum NADH oxidase 0.0036 0.008 0.1553
Trypanosoma cruzi trypanothione reductase, putative 0.0036 0.008 0.0293
Trichomonas vaginalis phosphofructokinase, putative 0.0121 0.041 0.1887
Toxoplasma gondii exonuclease III APE 0.0021 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0019 0.0015 0.0015
Entamoeba histolytica Flap nuclease, putative 0.0029 0.0052 0.0156
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0033 0.0066 0.7713
Brugia malayi phosphofructokinase 0.0121 0.041 0.062
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Entamoeba histolytica hypothetical protein 0.0043 0.0108 0.0426
Brugia malayi Kringle domain containing protein 0.0057 0.0162 0.0244
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0062 0.0064
Echinococcus granulosus leucyl aminopeptidase 0.0092 0.0297 0.031
Brugia malayi Aminopeptidase ZK353.6 in chromosome III 0.0092 0.0297 0.0448
Echinococcus granulosus puromycin sensitive aminopeptidase 0.038 0.1415 0.1484
Loa Loa (eye worm) hypothetical protein 0.0029 0.0052 0.0054
Loa Loa (eye worm) hypothetical protein 0.0174 0.0613 0.0643
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0019 0.0019
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.038 0.1415 0.6742
Brugia malayi Death domain containing protein 0.0016 0.0001 0.0001
Loa Loa (eye worm) matrix metalloproteinase 0.0019 0.0015 0.0015
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0266 0.0972 0.4105
Brugia malayi Uncoordinated protein 44 0.0016 0.0001 0.0001
Brugia malayi Protein kinase domain containing protein 0.0016 0.0001 0.0001
Schistosoma mansoni hypothetical protein 0.0057 0.0162 0.0168
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.003 0.0045
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0048 0.0029
Schistosoma mansoni 6-phosphofructokinase 0.0121 0.041 0.0429
Loa Loa (eye worm) hypothetical protein 0.0019 0.0012 0.0012
Echinococcus multilocularis leucyl aminopeptidase 0.0092 0.0297 0.031
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0048 0.0139
Trichomonas vaginalis glutathione reductase, putative 0.0036 0.008 0.0293
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Mycobacterium ulcerans hydrolase 0.0024 0.0031 0.005
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0067 0.0069
Echinococcus granulosus leucine aminopeptidase protein 0.0618 0.234 0.2454
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0554 0.209 1
Schistosoma mansoni lamin 0.003 0.0054 0.0056
Brugia malayi hypothetical protein 0.0554 0.209 0.3161
Trichomonas vaginalis phosphofructokinase, putative 0.0121 0.041 0.1887
Echinococcus granulosus lamin dm0 0.003 0.0054 0.0056
Loa Loa (eye worm) aminopeptidase in chromosome V 0.0092 0.0297 0.0311
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0121 0.041 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0067 0.0069
Mycobacterium leprae PROBABLE AMINOPEPTIDASE PEPC 0.0071 0.0215 0.0798
Brugia malayi Thioredoxin reductase 0.0105 0.0346 0.0523
Brugia malayi Peptidase family M1 containing protein 0.1102 0.4221 0.6386
Loa Loa (eye worm) hypothetical protein 0.0722 0.2744 0.2878
Loa Loa (eye worm) aminopeptidase N 0.0554 0.209 0.2192
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0054 0.0081
Trypanosoma brucei trypanothione reductase 0.0105 0.0346 0.1579
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0036 0.008 0.0261
Loa Loa (eye worm) hypothetical protein 0.0082 0.0259 0.0271
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0036 0.008 0.0293
Plasmodium falciparum glutathione reductase 0.0105 0.0346 0.0328
Loa Loa (eye worm) TATA binding protein associated factor 0.038 0.1415 0.1484
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0174 0.0613 0.0642
Toxoplasma gondii aminopeptidase n, putative 0.2589 1 1
Toxoplasma gondii hypothetical protein 0.0016 0.0001 0.0001
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0174 0.0613 0.0642
Plasmodium falciparum glutathione reductase 0.0036 0.008 0.0061
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0554 0.209 0.2191
Schistosoma mansoni PwLAP aminopeptidase (M17 family) 0.0092 0.0297 0.031
Echinococcus multilocularis lamin 0.003 0.0054 0.0056
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Trypanosoma cruzi pyroglutamyl-peptidase I, putative 0.0479 0.1802 0.8609
Plasmodium falciparum flap endonuclease 1 0.0029 0.0052 0.0033
Echinococcus multilocularis lamin dm0 0.003 0.0054 0.0056
Brugia malayi Flap endonuclease-1 0.0029 0.0052 0.0077
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0036 0.008 0.0079
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0036 0.008 0.0261
Echinococcus multilocularis Ankyrin 0.0016 0.0002 0.0001
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0033 0.0066 0.1198
Loa Loa (eye worm) hypothetical protein 0.0019 0.0015 0.0015
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0036 0.008 0.008
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.0001 0.0001
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0048 0.0048
Trichomonas vaginalis hypothetical protein 0.0033 0.0069 0.0237
Schistosoma mansoni 6-phosphofructokinase 0.0121 0.041 0.0429
Trypanosoma cruzi cytosolic leucyl aminopeptidase, putative 0.0462 0.1735 0.8286
Echinococcus multilocularis aspartyl aminopeptidase 0.0071 0.0215 0.0225
Schistosoma mansoni leucine aminopeptidase 0.0092 0.0297 0.031
Mycobacterium ulcerans 6-phosphofructokinase 0.0121 0.041 0.1684
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0036 0.008 0.0293
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0071 0.0215 0.0225
Brugia malayi 6-phosphofructokinase 0.0121 0.041 0.062
Echinococcus multilocularis leukotriene A 4 hydrolase 0.2469 0.9533 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0162 0.0169
Schistosoma mansoni ankyrin 23/unc44 0.0016 0.0001 0.0000000094092
Brugia malayi POT family protein 0.0046 0.0116 0.0174
Toxoplasma gondii 1,3(4)-beta-glucanase 0.0016 0.0001 0.0001
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0036 0.008 0.0061
Mycobacterium tuberculosis Probable oxidoreductase 0.0266 0.0972 0.4105
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0033 0.0066 0.0047
Echinococcus granulosus expressed conserved protein 0.0047 0.0121 0.0125
Trypanosoma cruzi hypothetical protein, conserved 0.0057 0.0162 0.0687
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0174 0.0613 0.2869
Brugia malayi 6-phosphofructokinase 0.0121 0.041 0.062
Onchocerca volvulus Matrilysin homolog 0.0019 0.0015 0.0033
Loa Loa (eye worm) aminopeptidase in chromosome III 0.0092 0.0297 0.0311
Echinococcus multilocularis thioredoxin glutathione reductase 0.0105 0.0346 0.0362
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0239 0.0868 0.3658
Loa Loa (eye worm) hypothetical protein 0.003 0.0054 0.0056
Plasmodium vivax 6-phosphofructokinase, putative 0.0033 0.0066 0.0066
Trypanosoma cruzi aminopeptidase, putative 0.038 0.1415 0.6742
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0016 0.0001 0.0001
Trypanosoma cruzi Cysteine peptidase, Clan CF, family C15 0.0479 0.1802 0.8609
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0036 0.008 0.0293
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0019 0.0019
Schistosoma mansoni hypothetical protein 0.0043 0.0108 0.0112
Brugia malayi Matrixin family protein 0.0019 0.0015 0.0021
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0121 0.041 0.1887
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.038 0.1415 0.6742
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0071 0.0215 0.0946
Trypanosoma brucei Aminopeptidase M1, putative 0.0554 0.209 1
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0033 0.0066 0.0226
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.038 0.1415 0.6742
Loa Loa (eye worm) hypothetical protein 0.0063 0.0182 0.019
Echinococcus multilocularis flap endonuclease 1 0.0029 0.0052 0.0053
Loa Loa (eye worm) TK/ROR protein kinase 0.0057 0.0162 0.0169
Toxoplasma gondii microneme protein MIC17C 0.0016 0.0001 0.0001
Echinococcus granulosus aspartyl aminopeptidase 0.0071 0.0215 0.0225
Trichomonas vaginalis DNA helicase recq1, putative 0.0024 0.003 0.0052
Echinococcus granulosus bloom syndrome protein 0.0024 0.003 0.003
Schistosoma mansoni hypothetical protein 0.0057 0.016 0.0167
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0027 0.0043 0.0064
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0108 0.0112
Schistosoma mansoni aminopeptidase A (M01 family) 0.038 0.1415 0.1484
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Toxoplasma gondii microneme protein, putative 0.0016 0.0001 0.0001
Toxoplasma gondii aminopeptidase N protein 0.2589 1 1
Schistosoma mansoni hypothetical protein 0.0028 0.0046 0.0047
Trypanosoma cruzi trypanothione reductase, putative 0.0105 0.0346 0.1579
Plasmodium vivax thioredoxin reductase, putative 0.0105 0.0346 0.0346
Loa Loa (eye worm) hypothetical protein 0.0548 0.207 0.2171
Brugia malayi cytosol aminopeptidase 0.0092 0.0297 0.0448
Mycobacterium tuberculosis Probable dehydrogenase 0.0239 0.0868 0.3658
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0048 0.0029
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0029 0.0052 0.0156
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0554 0.209 0.2191
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0016 0.0002 0.0001
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.038 0.1415 0.6742
Entamoeba histolytica hypothetical protein 0.0043 0.0108 0.0426
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0082 0.0259 0.039
Toxoplasma gondii hypothetical protein 0.0016 0.0001 0.0001
Trypanosoma brucei aminopeptidase, putative 0.0092 0.0297 0.134
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0239 0.0868 0.3658
Echinococcus granulosus baculoviral IAP repeat containing protein 0.0082 0.0259 0.027
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0036 0.008 0.0079
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0048 0.0139
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0239 0.0868 0.3627
Plasmodium falciparum thioredoxin reductase 0.0036 0.008 0.0061
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.038 0.1415 0.6742
Loa Loa (eye worm) phosphofructokinase 0.0121 0.041 0.043
Brugia malayi Aminopeptidase W07G4.4 in chromosome V 0.0092 0.0297 0.0448
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0036 0.008 0.0293
Brugia malayi hypothetical protein 0.0043 0.0108 0.0162
Mycobacterium ulcerans aminopeptidase N PepN 0.0554 0.209 0.8921
Onchocerca volvulus Matrix metalloproteinase homolog 0.0043 0.0107 0.0251
Toxoplasma gondii subtilisin SUB12 0.0016 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0016 0.0002 0.0001
Onchocerca volvulus Matrilysin homolog 0.0043 0.0107 0.0251
Wolbachia endosymbiont of Brugia malayi leucyl aminopeptidase 0.0618 0.234 1
Trypanosoma brucei pyroglutamyl-peptidase I, putative 0.0479 0.1802 0.8609
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Schistosoma mansoni inhibitor of apoptosis protein 0.0082 0.0259 0.027
Echinococcus multilocularis bloom syndrome protein 0.0024 0.003 0.003
Loa Loa (eye worm) flap endonuclease-1 0.0029 0.0052 0.0054
Loa Loa (eye worm) hypothetical protein 0.0024 0.0031 0.0032
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0036 0.008 0.0083
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0019 0.0015 0.0014
Loa Loa (eye worm) matrixin family protein 0.0047 0.0122 0.0127
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.038 0.1415 0.1399
Entamoeba histolytica phosphofructokinase, putative 0.0121 0.041 0.1887
Leishmania major aspartyl aminopeptidase, putative,metallo-peptidase, Clan MH, Family M20 0.0071 0.0215 0.0946
Brugia malayi Matrixin family protein 0.0047 0.0122 0.0183
Trypanosoma cruzi aminopeptidase, putative 0.0554 0.209 1
Echinococcus granulosus inhibitor of apoptosis protein 0.0082 0.0259 0.027
Mycobacterium ulcerans leucyl aminopeptidase 0.0618 0.234 1
Entamoeba histolytica phosphofructokinase, putative 0.0121 0.041 0.1887
Entamoeba histolytica aspartyl aminopeptidase, putative 0.0071 0.0215 0.0946
Trichomonas vaginalis set domain proteins, putative 0.0261 0.0953 0.451
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0016 0.0001 0.0000000094092
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0067 0.0069
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0554 0.209 1
Leishmania major hypothetical protein, conserved 0.0057 0.0162 0.0687
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0082 0.0259 0.039
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0092 0.0297 0.0448
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0071 0.0215 0.0225
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0554 0.209 1
Brugia malayi Cell death protein 3 precursor 0.0063 0.0182 0.0275
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Echinococcus granulosus nuclear factor of activated T cells 5 0.0082 0.0258 0.027
Toxoplasma gondii microneme protein MIC17B 0.0016 0.0001 0.0001
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0019 0.0019
Onchocerca volvulus Cell death protein 3 homolog 0.0063 0.0182 0.043
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0036 0.008 0.0293
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Toxoplasma gondii leucyl aminopeptidase LAP 0.0618 0.234 0.234
Entamoeba histolytica hypothetical protein 0.0043 0.0108 0.0426
Loa Loa (eye worm) hypothetical protein 0.0082 0.0259 0.0271
Leishmania major cytosolic leucyl aminopeptidase,metallo-peptidase, Clan MF, Family M17 0.0462 0.1735 0.8286
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0067 0.0069
Onchocerca volvulus 0.0082 0.0259 0.0611
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0071 0.0215 0.0946
Giardia lamblia NADH oxidase lateral transfer candidate 0.0036 0.008 1
Plasmodium vivax M17 leucyl aminopeptidase, putative 0.0618 0.234 0.234
Schistosoma mansoni ap endonuclease 0.0021 0.0019 0.0019
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Loa Loa (eye worm) hypothetical protein 0.0354 0.1315 0.1378
Trypanosoma cruzi metallo-peptidase, Clan MH, Family M20 0.0071 0.0215 0.0946
Toxoplasma gondii NADPH-glutathione reductase 0.0036 0.008 0.008
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0554 0.209 0.2191
Schistosoma mansoni lamin 0.003 0.0054 0.0056
Echinococcus multilocularis aminopeptidase N 0.1102 0.4221 0.4427
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0036 0.008 0.0293
Loa Loa (eye worm) leukotriene A4 hydrolase 0.2469 0.9533 1
Echinococcus granulosus flap endonuclease 1 0.0029 0.0052 0.0053
Trypanosoma brucei aminopeptidase, putative 0.038 0.1415 0.6742
Trichomonas vaginalis phosphofructokinase, putative 0.0121 0.041 0.1887
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0067 0.0069
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.038 0.1415 0.6742
Brugia malayi Aspartyl aminopeptidase 0.0071 0.0215 0.0325
Plasmodium vivax glutathione reductase, putative 0.0105 0.0346 0.0346
Schistosoma mansoni flap endonuclease-1 0.0026 0.0041 0.0042
Echinococcus multilocularis apoptotic protease activating factor 1 0.0063 0.0182 0.019
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0071 0.0215 0.0946
Echinococcus multilocularis tissue type plasminogen activator 0.0057 0.0162 0.0168
Mycobacterium tuberculosis Probable reductase 0.0239 0.0868 0.3658
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.038 0.1415 0.1415
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.0011 0.001
Echinococcus multilocularis baculoviral IAP repeat containing protein 0.0082 0.0259 0.027
Echinococcus multilocularis 6 phosphofructokinase 0.0121 0.041 0.0429
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0036 0.008 0.0261
Onchocerca volvulus 0.003 0.0054 0.0127
Brugia malayi hypothetical protein 0.0136 0.0467 0.0705
Onchocerca volvulus 0.0063 0.0182 0.043
Mycobacterium tuberculosis Probable aminopeptidase PepC 0.0071 0.0215 0.0844
Brugia malayi hypothetical protein 0.038 0.1415 0.2141
Trichomonas vaginalis phosphofructokinase, putative 0.0033 0.0066 0.0226
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0266 0.0972 0.4105
Leishmania major hypothetical protein, conserved 0.0028 0.0048 0.0139
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0019 0.002
Loa Loa (eye worm) hypothetical protein 0.038 0.1415 0.1484
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0029 0.0052 0.0156
Brugia malayi Hemopexin family protein 0.0028 0.0046 0.0069
Plasmodium vivax SET domain protein, putative 0.0033 0.0067 0.0066
Echinococcus granulosus ankyrin repeat domain containing protein 17 0.0092 0.0297 0.031
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0036 0.008 0.0261
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0036 0.008 0.0293
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0033 0.0069 0.0237
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0048 0.0048
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0067 0.0069
Onchocerca volvulus 0.0057 0.0162 0.0382
Toxoplasma gondii kringle domain-containing protein 0.0057 0.0162 0.0162
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0108 0.0112
Schistosoma mansoni hypothetical protein 0.0082 0.0259 0.027
Toxoplasma gondii PAN/Apple domain-containing protein 0.0016 0.0001 0.0001
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0033 0.0066 0.0066
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0067 0.0069
Loa Loa (eye worm) intermediate filament protein 0.003 0.0054 0.0056
Onchocerca volvulus 0.0028 0.0046 0.0108
Toxoplasma gondii aminopeptidase N, putative 0.2589 1 1
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0033 0.0069 0.0237
Onchocerca volvulus 0.003 0.0054 0.0127
Echinococcus multilocularis musashi 0.003 0.0054 0.0056
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0071 0.0215 0.0225
Loa Loa (eye worm) hypothetical protein 0.038 0.1415 0.1484
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0239 0.0868 0.3658
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0036 0.008 0.012
Entamoeba histolytica hypothetical protein 0.0043 0.0108 0.0426
Echinococcus multilocularis leucyl aminopeptidase 0.0092 0.0297 0.031
Echinococcus granulosus aminopeptidase N 0.1102 0.4221 0.4427
Toxoplasma gondii microneme protein MIC17A 0.0016 0.0001 0.0001
Entamoeba histolytica aminopeptidase, putative 0.0554 0.209 1
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0069 0.0237
Brugia malayi Pre-SET motif family protein 0.0229 0.083 0.1255
Onchocerca volvulus 0.0019 0.0015 0.0033
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0562 0.2121 0.2224
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0036 0.008 0.0061
Onchocerca volvulus 0.038 0.1415 0.3352
Echinococcus multilocularis caspase 2 0.0063 0.0182 0.019
Echinococcus multilocularis inhibitor of apoptosis protein 0.0082 0.0259 0.027
Loa Loa (eye worm) hypothetical protein 0.0028 0.0048 0.005
Brugia malayi Matrixin family protein 0.0019 0.0015 0.0021
Trichomonas vaginalis flap endonuclease-1, putative 0.0029 0.0052 0.0156
Leishmania major trypanothione reductase 0.0105 0.0346 0.1579
Brugia malayi TATA binding protein associated factor 0.038 0.1415 0.2141
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0054 0.0056
Loa Loa (eye worm) hypothetical protein 0.0174 0.0613 0.0643
Chlamydia trachomatis cytosol aminopeptidase 0.0618 0.234 1
Loa Loa (eye worm) thioredoxin reductase 0.0105 0.0346 0.0363
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.0069 0.0237
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Schistosoma mansoni intermediate filament proteins 0.003 0.0054 0.0056
Onchocerca volvulus Deterin homolog 0.0082 0.0259 0.0611
Plasmodium falciparum M18 aspartyl aminopeptidase 0.0071 0.0215 0.0197
Brugia malayi Peptidase family M1 containing protein 0.038 0.1415 0.2141
Toxoplasma gondii PAN domain-containing protein 0.0016 0.0001 0.0001
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0071 0.0214 0.0223
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.2469 0.9533 1
Onchocerca volvulus 0.0033 0.0067 0.0157
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0071 0.0215 0.0946
Onchocerca volvulus Netrin receptor homolog 0.0016 0.0001 0.0001
Loa Loa (eye worm) peptidase family M1 containing protein 0.0928 0.3546 0.372
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0067 0.0067
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0092 0.0297 0.134
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0033 0.0066 0.0226
Loa Loa (eye worm) hypothetical protein 0.0033 0.0067 0.0069
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0554 0.209 1
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0024 0.0031 0.0046
Schistosoma mansoni caspase-7 (C14 family) 0.0063 0.0182 0.019
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0048 0.0139
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.2589 1 1
Mycobacterium leprae Probable cytosol aminopeptidase PepB 0.0618 0.234 1
Trypanosoma cruzi aspartyl aminopeptidase, putative 0.0071 0.0215 0.0946
Plasmodium falciparum cysteine repeat modular protein 1 0.0057 0.0162 0.0143
Loa Loa (eye worm) hypothetical protein 0.0063 0.0182 0.019
Plasmodium vivax 6-phosphofructokinase, putative 0.0033 0.0066 0.0066
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0019 0.0028
Schistosoma mansoni inhibitor of apoptosis (iap) domain family member 0.0082 0.0259 0.027
Brugia malayi Peptidase family M1 containing protein 0.0554 0.209 0.3161
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0033 0.0069 0.0237
Echinococcus granulosus intermediate filament protein 0.003 0.0054 0.0056
Loa Loa (eye worm) POT family protein 0.0046 0.0116 0.0121
Loa Loa (eye worm) aspartyl aminopeptidase 0.0071 0.0215 0.0225
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0239 0.0868 0.3658
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0016 0.0001 0.0000000094092
Onchocerca volvulus 0.0261 0.0954 0.2258
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.003 0.0052
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Trypanosoma cruzi Aminopeptidase M1, putative 0.0554 0.209 1
Plasmodium vivax M18 aspartyl aminopeptidase, putative 0.0071 0.0215 0.0215
Loa Loa (eye worm) glutathione reductase 0.0105 0.0346 0.0363
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0121 0.041 0.1887
Brugia malayi intermediate filament protein 0.003 0.0054 0.0081
Loa Loa (eye worm) 6-phosphofructokinase 0.0121 0.041 0.043
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0036 0.008 0.0083
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0036 0.008 0.0261
Entamoeba histolytica aminopeptidase, putative 0.0071 0.0215 0.0946
Plasmodium falciparum thioredoxin reductase 0.0105 0.0346 0.0328
Brugia malayi Matrixin family protein 0.0019 0.0015 0.0021
Echinococcus multilocularis leucine aminopeptidase protein 0.0618 0.234 0.2454
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0036 0.008 0.0083
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0036 0.008 0.0293
Loa Loa (eye worm) hypothetical protein 0.038 0.1415 0.1484
Echinococcus multilocularis expressed conserved protein 0.0047 0.0121 0.0125
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.038 0.1415 0.1484
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0108 0.0112
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0036 0.008 0.0293
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0036 0.008 0.0061
Echinococcus multilocularis nuclear factor of activated T cells 5 0.0082 0.0258 0.027
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0121 0.041 0.1642
Echinococcus granulosus leukotriene A 4 hydrolase 0.2469 0.9533 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 10.3225 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) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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.