Detailed information for compound 262377

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 378.305 | Formula: C17H13F3N4O3
  • H donors: 3 H acceptors: 3 LogP: 3.12 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)Nc1[nH]c2c(n1)cc(cc2)C(=O)Nc1ccc(cc1)C(F)(F)F
  • InChi: 1S/C17H13F3N4O3/c1-27-16(26)24-15-22-12-7-2-9(8-13(12)23-15)14(25)21-11-5-3-10(4-6-11)17(18,19)20/h2-8H,1H3,(H,21,25)(H2,22,23,24,26)
  • InChiKey: XCYONJWDRYMFMA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni thyroid hormone receptor 0.015 0.294 0.344
Loa Loa (eye worm) hypothetical protein 0.0349 0.7172 0.8393
Schistosoma mansoni glutamate synthase 0.0012 0.0019 0.0023
Mycobacterium tuberculosis Conserved protein 0.0076 0.1366 0.1349
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0729 0.0853
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0142 0.2784 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0961 0.3408
Loa Loa (eye worm) hypothetical protein 0.0031 0.0426 0.0499
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0045 0.0723 0.0846
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0729 0.0853
Echinococcus multilocularis transcription factor Dp 1 0.0042 0.0656 0.0768
Plasmodium falciparum glutathione reductase 0.0131 0.254 1
Mycobacterium ulcerans beta-lactamase 0.0076 0.1366 0.4872
Echinococcus multilocularis bloom syndrome protein 0.0024 0.0262 0.0307
Schistosoma mansoni peroxidasin 0.0414 0.8545 1
Mycobacterium tuberculosis Conserved protein 0.0076 0.1366 0.1349
Schistosoma mansoni hypothetical protein 0.0187 0.3721 0.4354
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0045 0.0726 0.2556
Trichomonas vaginalis DNA helicase recq, putative 0.0013 0.003 0.0018
Schistosoma mansoni transcription factor LCR-F1 0.007 0.124 0.1451
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0056 0.0961 0.0944
Onchocerca volvulus 0.0076 0.1366 0.1599
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0729 0.0853
Loa Loa (eye worm) RecQ helicase 0.0024 0.0262 0.0307
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0012 0.0019 0.0023
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0073 0.1305 0.5009
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.137 0.526
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0073 0.1305 0.1528
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0014 0.006 0.0069
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.0817 0.0799
Schistosoma mansoni glutamate synthase 0.0012 0.0019 0.0023
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0073 0.1305 0.1528
Trichomonas vaginalis esterase, putative 0.0076 0.1366 0.2273
Brugia malayi hypothetical protein 0.007 0.124 0.1451
Onchocerca volvulus Dual oxidase homolog 0.0414 0.8545 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0045 0.0726 0.2752
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0729 0.0853
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0961 0.1125
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0045 0.0726 0.2803
Entamoeba histolytica hypothetical protein 0.007 0.124 0.1814
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Loa Loa (eye worm) hypothetical protein 0.0099 0.1857 0.2173
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0012 0.0019 0.0023
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Mycobacterium leprae Probable lipase LipE 0.0076 0.1366 0.4872
Schistosoma mansoni blooms syndrome DNA helicase 0.0019 0.0157 0.0184
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0015 0.0086 0.0258
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0016 0.0101 0.0324
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0014 0.006 0.0061
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0031 0.0426 0.0499
Schistosoma mansoni sulfide quinone reductase 0.0012 0.0019 0.0023
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1061 0.1242
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0012 0.0019 0.0023
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0073 0.1305 0.5009
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0131 0.254 0.2525
Loa Loa (eye worm) glutathione reductase 0.0131 0.254 0.2972
Onchocerca volvulus Chorion peroxidase homolog 0.0414 0.8545 1
Schistosoma mansoni peroxidasin 0.0414 0.8545 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0133 0.2587 0.3027
Loa Loa (eye worm) hypothetical protein 0.0133 0.2587 0.3027
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0015 0.0086 0.01
Trypanosoma cruzi hypothetical protein, conserved 0.0014 0.006 0.0159
Trypanosoma brucei hypothetical protein, conserved 0.0076 0.1366 0.5246
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0045 0.0726 0.085
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Plasmodium falciparum glutathione reductase 0.0045 0.0726 0.2803
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0099 0.1857 0.2173
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0045 0.0726 0.2556
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0729 0.0853
Leishmania major phosphatidylinositol 3-kinase, putative 0.0015 0.0086 0.0258
Mycobacterium ulcerans lipase LipD 0.0076 0.1366 0.4872
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0015 0.0086 0.01
Brugia malayi beta-lactamase family protein 0.0076 0.1366 0.1599
Leishmania major oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein 0.0053 0.0887 0.3378
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0045 0.0726 0.0708
Brugia malayi RNA binding protein 0.0061 0.1061 0.1242
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0527 0.0856
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0014 0.006 0.007
Brugia malayi hypothetical protein 0.0329 0.6746 0.7895
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Mycobacterium leprae PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B) 0.0053 0.0887 0.3138
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Brugia malayi hypothetical protein 0.0134 0.2606 0.305
Schistosoma mansoni hypothetical protein 0.0067 0.1195 0.1398
Entamoeba histolytica hypothetical protein 0.007 0.124 0.1814
Trypanosoma brucei Alpha/beta hydrolase domain-containing protein 0.0014 0.006 0.0159
Toxoplasma gondii ABC1 family protein 0.0076 0.1366 0.5246
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0014 0.006 0.007
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.1366 0.2273
Loa Loa (eye worm) hypothetical protein 0.0329 0.6746 0.7895
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.0262 0.0307
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0014 0.006 0.0159
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0961 0.1125
Echinococcus granulosus protein cereblon 0.0329 0.6746 0.7895
Onchocerca volvulus 0.0414 0.8545 1
Trypanosoma cruzi oligopeptidase b 0.0053 0.0887 0.3378
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0031 0.0426 0.0499
Echinococcus multilocularis prolyl endopeptidase 0.0133 0.2587 0.3027
Schistosoma mansoni hypothetical protein 0.0012 0.0019 0.0023
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0723 0.1187
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0045 0.0726 0.2803
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Mycobacterium leprae conserved hypothetical protein 0.0076 0.1366 0.4872
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0527 0.0856
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0012 0.0019 0.0023
Trichomonas vaginalis penicillin-binding protein, putative 0.0076 0.1366 0.2273
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0337 0.0536
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0053 0.0881 0.1031
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0045 0.0726 0.2752
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1061 0.1242
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0729 0.0853
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Brugia malayi latrophilin 2 splice variant baaae 0.0067 0.1195 0.1398
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0045 0.0723 0.0846
Brugia malayi Calcitonin receptor-like protein seb-1 0.0099 0.1857 0.2173
Leishmania major oligopeptidase b 0.0053 0.0887 0.3378
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0015 0.0086 0.01
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0045 0.0726 0.085
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0045 0.0726 0.5232
Giardia lamblia Fructose-bisphosphate aldolase 0.0292 0.5945 1
Echinococcus granulosus peroxidasin 0.0414 0.8545 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0015 0.0086 0.0258
Trypanosoma cruzi trypanothione reductase, putative 0.0045 0.0726 0.2752
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0292 0.5945 0.881
Loa Loa (eye worm) phosphatidylinositol 3 0.0015 0.0086 0.01
Trichomonas vaginalis DNA helicase recq1, putative 0.0024 0.0262 0.041
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0045 0.0723 0.274
Brugia malayi Latrophilin receptor protein 2 0.0031 0.0426 0.0499
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Loa Loa (eye worm) RNA binding protein 0.0061 0.1061 0.1242
Brugia malayi hypothetical protein 0.0414 0.8545 1
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0012 0.0019 0.0023
Echinococcus granulosus thioredoxin glutathione reductase 0.0131 0.254 0.2972
Trichomonas vaginalis Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase 0.0014 0.006 0.0069
Plasmodium vivax hypothetical protein, conserved 0.0014 0.006 0.0162
Mycobacterium tuberculosis Probable peptidase 0.0053 0.0887 0.0869
Loa Loa (eye worm) thioredoxin reductase 0.0131 0.254 0.2972
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0045 0.0726 0.2752
Toxoplasma gondii hypothetical protein 0.0026 0.0317 0.116
Trypanosoma cruzi oligopeptidase b 0.0053 0.0887 0.3378
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.1061 0.1242
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Echinococcus multilocularis tar DNA binding protein 0.0061 0.1061 0.1242
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0019 0.0162 0.0557
Plasmodium falciparum thioredoxin reductase 0.0131 0.254 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0012 0.0021 0.0003
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0086 0.0112
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0086 0.0112
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0012 0.0019 0.0023
Echinococcus multilocularis geminin 0.0187 0.3721 0.4354
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0031 0.0426 0.0499
Toxoplasma gondii hypothetical protein 0.0014 0.006 0.0159
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0012 0.0019 0.0023
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0012 0.0019 0.0023
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.006 0.0069
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.1366 0.2273
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 0.4886
Plasmodium vivax glutathione reductase, putative 0.0131 0.254 1
Toxoplasma gondii thioredoxin reductase 0.0131 0.254 0.9817
Echinococcus granulosus beta LACTamase domain containing family member 0.0076 0.1366 0.1599
Onchocerca volvulus Peroxidase homolog 0.0414 0.8545 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0014 0.006 0.007
Brugia malayi Animal haem peroxidase family protein 0.0414 0.8545 1
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0033 0.0471 0.0551
Schistosoma mansoni hypothetical protein 0.0329 0.6746 0.7895
Schistosoma mansoni hypothetical protein 0.0031 0.0426 0.0499
Loa Loa (eye worm) hypothetical protein 0.0014 0.006 0.007
Mycobacterium tuberculosis Probable protease II PtrBb [second part] (oligopeptidase B) 0.0053 0.0887 0.0869
Echinococcus granulosus geminin 0.0187 0.3721 0.4354
Giardia lamblia Alanyl dipeptidyl peptidase 0.0014 0.006 0.0069
Trypanosoma brucei oligopeptidase b 0.0053 0.0887 0.3378
Brugia malayi Thioredoxin reductase 0.0131 0.254 0.2972
Echinococcus granulosus acylamino acid releasing enzyme 0.0014 0.006 0.007
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0331 0.0526
Brugia malayi Animal haem peroxidase family protein 0.0414 0.8545 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Toxoplasma gondii NADPH-glutathione reductase 0.0045 0.0726 0.2752
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0073 0.1305 0.1528
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0073 0.1305 0.1528
Trypanosoma cruzi oligopeptidase B-like protein, putative 0.0053 0.0887 0.3378
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0026 0.0317 0.1078
Loa Loa (eye worm) blistered cuticle protein 3 0.0414 0.8545 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.0817 0.0956
Brugia malayi prolyl oligopeptidase family protein 0.0014 0.006 0.007
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0045 0.0726 0.2752
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0142 0.2784 0.277
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0045 0.0726 0.085
Plasmodium falciparum thioredoxin reductase 0.0045 0.0726 0.2803
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0045 0.0726 0.2803
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0282 0.0443
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0292 0.5945 0.881
Loa Loa (eye worm) animal heme peroxidase 0.0414 0.8545 1
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0139 0.2704 0.3164
Echinococcus granulosus tar DNA binding protein 0.0061 0.1061 0.1242
Entamoeba histolytica prolyl oligopeptidase family protein 0.0014 0.006 0.0061
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.007 0.124 0.1451
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0014 0.006 0.007
Mycobacterium tuberculosis Probable protease II PtrBa [first part] (oligopeptidase B) 0.0119 0.2291 0.2276
Trichomonas vaginalis D-aminoacylase, putative 0.0076 0.1366 0.2273
Loa Loa (eye worm) hypothetical protein 0.0076 0.137 0.1603
Echinococcus granulosus GPCR family 2 0.0031 0.0426 0.0499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0281 0.0441
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0076 0.1366 0.1349
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0255 0.5172 0.6053
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0045 0.0723 0.274
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.0202 0.0724
Schistosoma mansoni hypothetical protein 0.007 0.124 0.1451
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Loa Loa (eye worm) beta-lactamase 0.0076 0.1366 0.1599
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 1
Loa Loa (eye worm) animal heme peroxidase 0.0414 0.8545 1
Trypanosoma cruzi trypanothione reductase, putative 0.0131 0.254 0.9817
Entamoeba histolytica hypothetical protein, conserved 0.0329 0.6746 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0723 0.1187
Loa Loa (eye worm) programmed cell death 8 0.0012 0.0019 0.0023
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0527 0.0856
Onchocerca volvulus 0.0076 0.1366 0.1599
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0142 0.2784 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0045 0.0723 0.274
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0045 0.0726 0.5232
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0045 0.0723 0.1046
Onchocerca volvulus Peroxidasin homolog 0.0414 0.8545 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0012 0.0019 0.0023
Schistosoma mansoni hypothetical protein 0.0187 0.3721 0.4354
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.1366 0.5246
Brugia malayi beta-lactamase 0.0076 0.1366 0.1599
Onchocerca volvulus 0.0012 0.0019 0.0023
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0014 0.006 0.0159
Trypanosoma brucei prolyl endopeptidase 0.0133 0.2587 1
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0045 0.0726 0.2556
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0056 0.0961 0.1125
Loa Loa (eye worm) animal heme peroxidase 0.0414 0.8545 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0076 0.1366 0.1599
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0056 0.0961 0.1125
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1061 0.1242
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0031 0.0426 0.0499
Echinococcus multilocularis thyroid hormone receptor alpha 0.015 0.294 0.344
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0282 0.0443
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Mycobacterium tuberculosis Probable lipase LipD 0.0076 0.1366 0.1349
Trypanosoma brucei serine peptidase, clan SC, family S9A-like protein 0.0053 0.0887 0.3378
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0045 0.0723 0.1046
Echinococcus multilocularis beta LACTamase domain containing family member 0.0076 0.1366 0.1599
Echinococcus multilocularis glutamate synthase 0.0012 0.0019 0.0023
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0014 0.006 0.0159
Plasmodium vivax thioredoxin reductase, putative 0.0131 0.254 1
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0961 0.3408
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0076 0.1366 0.1349
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0015 0.0086 0.0258
Schistosoma mansoni glutamate synthase 0.0012 0.0019 0.0023
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0045 0.0726 0.0708
Onchocerca volvulus Protein cereblon homolog 0.0329 0.6746 0.7895
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0036 0.0527 0.1979
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0012 0.0019 0.0023
Onchocerca volvulus 0.0414 0.8545 1
Leishmania major hypothetical protein, conserved 0.0076 0.1366 0.5246
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0076 0.1366 0.4872
Treponema pallidum NADH oxidase 0.0045 0.0726 0.1192
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0161 0.0189
Treponema pallidum fructose-bisphosphate aldolase 0.0292 0.5945 1
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0012 0.0019 0.0023
Loa Loa (eye worm) hypothetical protein 0.0014 0.006 0.007
Brugia malayi prolyl oligopeptidase family protein 0.0014 0.006 0.007
Onchocerca volvulus Peroxidasin homolog 0.0414 0.8545 1
Entamoeba histolytica prolyl oligopeptidase family protein 0.0014 0.006 0.0061
Toxoplasma gondii acylaminoacyl-peptidase, putative 0.0014 0.006 0.0159
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0012 0.0019 0.0023
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 0.137 0.4886
Schistosoma mansoni hypothetical protein 0.0031 0.0426 0.0499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0281 0.0441
Trypanosoma cruzi hypothetical protein, conserved 0.0076 0.1366 0.5246
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0045 0.0726 0.2752
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0014 0.006 0.007
Echinococcus granulosus Dipeptidyl peptidase 9 0.0014 0.006 0.007
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.003 0.0042
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0076 0.1366 0.1599
Onchocerca volvulus Peroxidase homolog 0.0414 0.8545 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Echinococcus multilocularis GPCR, family 2 0.0031 0.0426 0.0499
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0026 0.0317 0.1182
Trypanosoma cruzi serine peptidase, clan SC, family S9A-like protein, putative 0.0053 0.0887 0.3378
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0045 0.0723 0.274
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0015 0.0086 0.0258
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0026 0.0317 0.0503
Brugia malayi Animal haem peroxidase family protein 0.0414 0.8545 1
Trypanosoma brucei prolyl oligopeptidase, putative 0.0053 0.0887 0.3378
Brugia malayi Animal haem peroxidase family protein 0.0414 0.8545 1
Brugia malayi glutamate synthase 0.0012 0.0019 0.0023
Loa Loa (eye worm) prolyl oligopeptidase 0.0014 0.006 0.007
Brugia malayi beta-lactamase family protein 0.0076 0.1366 0.1599
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0073 0.1305 0.5009
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0282 0.0443
Trichomonas vaginalis PIKK family atypical protein kinase 0.0045 0.0723 0.1187
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0386 0.0619
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0337 0.0536
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0086 0.0112
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0036 0.0527 0.1979
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0331 0.0526
Brugia malayi Peroxidasin 0.0414 0.8545 1
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.003 0.0042
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.0583 0.095
Echinococcus granulosus transcription factor Dp 1 0.0042 0.0656 0.0768
Giardia lamblia NADH oxidase lateral transfer candidate 0.0045 0.0726 0.1192
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0015 0.0086 0.0258
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0282 0.0443
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0045 0.0723 0.274
Echinococcus multilocularis peroxidasin 0.0414 0.8545 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0131 0.254 0.2972
Schistosoma mansoni disulfide oxidoreductase 0.0012 0.0019 0.0023
Schistosoma mansoni thyroid hormone receptor 0.015 0.294 0.344
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0045 0.0723 0.0846
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 1
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1061 0.1242
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0012 0.0019 0.0023
Brugia malayi TAR-binding protein 0.0061 0.1061 0.1242
Mycobacterium ulcerans esterase/lipase LipP 0.0076 0.1366 0.4872
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0073 0.1305 0.1912
Brugia malayi Animal haem peroxidase family protein 0.0414 0.8545 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0031 0.0426 0.0499
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0056 0.0961 0.3669
Entamoeba histolytica prolyl oligopeptidase family protein 0.0014 0.006 0.0061
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0729 0.0853
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 0.4886
Mycobacterium tuberculosis Probable oxidoreductase 0.0045 0.0726 0.0708
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0016 0.0097 0.0302
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Brugia malayi prolyl oligopeptidase family protein 0.0014 0.006 0.007
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0012 0.0019 0.0023
Echinococcus multilocularis acylamino acid releasing enzyme 0.0014 0.006 0.007
Echinococcus granulosus peptidase Clp S14 family 0.005 0.0817 0.0956
Mycobacterium tuberculosis Conserved protein 0.0076 0.1366 0.1349
Brugia malayi Probable ClpP-like protease 0.0076 0.137 0.1603
Loa Loa (eye worm) hypothetical protein 0.0067 0.1195 0.1398
Schistosoma mansoni hypothetical protein 0.0031 0.0426 0.0499
Entamoeba histolytica recQ family helicase, putative 0.0013 0.003 0.0016
Onchocerca volvulus Prolyl endopeptidase homolog 0.0133 0.2587 0.3027
Brugia malayi Blistered cuticle protein 3 0.0414 0.8545 1
Trypanosoma cruzi hypothetical protein, conserved 0.0014 0.006 0.0159
Loa Loa (eye worm) hypothetical protein 0.0076 0.1366 0.1599
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Trichomonas vaginalis glutathione reductase, putative 0.0045 0.0726 0.1192
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0073 0.1305 0.5009
Loa Loa (eye worm) latrophilin receptor protein 2 0.0031 0.0426 0.0499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0527 0.0856
Trypanosoma brucei trypanothione reductase 0.0131 0.254 0.9817
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.1061 0.1242
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 0.137 0.1603
Plasmodium falciparum peptidase, putative 0.0014 0.006 0.0162
Schistosoma mansoni hypothetical protein 0.0031 0.0426 0.0499
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 0.5358
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0014 0.006 0.0159
Mycobacterium tuberculosis Probable esterase LipL 0.0076 0.1366 0.1349
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0086 0.0112
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0045 0.0723 0.0846
Schistosoma mansoni sulfide quinone reductase 0.0012 0.0019 0.0023
Mycobacterium ulcerans hypothetical protein 0.0076 0.1366 0.4872
Onchocerca volvulus 0.0076 0.1366 0.1599
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0262 0.041
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0014 0.006 0.007
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0014 0.006 0.007
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0012 0.0019 0.0023
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 1
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0015 0.0086 0.01
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0527 0.0856
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0014 0.006 0.0159
Echinococcus granulosus bloom syndrome protein 0.0024 0.0262 0.0307
Mycobacterium tuberculosis Probable hydrolase 0.0076 0.1366 0.1349
Giardia lamblia Alanyl dipeptidyl peptidase 0.0014 0.006 0.0069
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Leishmania major trypanothione reductase 0.0131 0.254 0.9817
Brugia malayi follicle stimulating hormone receptor 0.0255 0.5172 0.6053
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 0.137 0.5358
Trichomonas vaginalis PIKK family atypical protein kinase 0.0024 0.0281 0.0441
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1061 0.1242
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0014 0.006 0.0061
Toxoplasma gondii target of rapamycin (TOR), putative 0.0034 0.0477 0.1783
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0086 0.0112
Trypanosoma cruzi prolyl endopeptidase 0.0133 0.2587 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0045 0.0726 0.2752
Echinococcus multilocularis protein cereblon 0.0329 0.6746 0.7895
Toxoplasma gondii prolyl endopeptidase 0.0133 0.2587 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0045 0.0726 0.085
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0045 0.0726 0.0708
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0729 0.0853
Loa Loa (eye worm) phosphatidylinositol 3 0.0045 0.0723 0.0846
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 0.137 0.1603
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0133 0.2587 0.3027
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0073 0.1305 0.1528
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.003 0.0042
Plasmodium vivax hypothetical protein, conserved 0.0076 0.1366 0.5344
Echinococcus granulosus glutamate synthase 0.0012 0.0019 0.0023
Trichomonas vaginalis mercuric reductase, putative 0.0045 0.0726 0.1192
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0045 0.0726 0.2803
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0026 0.0317 0.1182
Leishmania major prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative 0.0133 0.2587 1
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0139 0.2704 0.3164
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0045 0.0726 0.2752
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0292 0.5945 1
Loa Loa (eye worm) animal heme peroxidase 0.0414 0.8545 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.0407 0.0654
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.137 0.526
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0045 0.0726 0.5232
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0014 0.006 0.0159
Echinococcus granulosus prolyl endopeptidase 0.0133 0.2587 0.3027
Loa Loa (eye worm) hypothetical protein 0.0414 0.8545 1
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 0.137 0.1603
Onchocerca volvulus 0.0414 0.8545 1
Schistosoma mansoni hypothetical protein 0.0139 0.2704 0.3164
Brugia malayi glutathione reductase 0.0131 0.254 0.2972
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0045 0.0726 0.2752
Mycobacterium ulcerans protease II (oligopeptidase B), PtrB 0.0053 0.0887 0.3138
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 0.137 0.2279
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0076 0.1366 0.1599
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0045 0.0726 0.2556
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0477 0.0772
Trichomonas vaginalis penicillin-binding protein, putative 0.0076 0.1366 0.2273
Trypanosoma cruzi target of rapamycin kinase 3 0.0036 0.0527 0.1979
Brugia malayi prolyl oligopeptidase family protein 0.0014 0.006 0.007
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0099 0.1857 0.2173
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0076 0.1366 0.1349
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0045 0.0726 0.2752
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0033 0.0471 0.0551
Loa Loa (eye worm) TAR-binding protein 0.0061 0.1061 0.1242
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0729 0.0853
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0014 0.006 0.007
Entamoeba histolytica hypothetical protein 0.007 0.124 0.1814
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0012 0.0019 0.0023
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0337 0.0536
Giardia lamblia GTOR 0.0045 0.0723 0.1187
Loa Loa (eye worm) hypothetical protein 0.0012 0.0019 0.0023
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0076 0.1366 0.1599
Brugia malayi prolyl oligopeptidase family protein 0.0133 0.2587 0.3027
Entamoeba histolytica hypothetical protein, conserved 0.0014 0.006 0.0061
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0014 0.006 0.007
Entamoeba histolytica hypothetical protein 0.007 0.124 0.1814
Mycobacterium tuberculosis Probable lipase LipE 0.0076 0.1366 0.1349
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0045 0.0723 0.274
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.007 0.124 0.1451
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0021 0.0217 0.0772
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.0817 0.2884
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.0817 0.0799
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0045 0.0726 0.2752

Activities

Activity type Activity value Assay description Source Reference
Control (functional) = 77 % Antifilarial activity measured against the adult worms of A. vitae in jirds by subcutaneous administration ChEMBL. 1738146
Control (functional) = 100 % In vitro test against L1210 murine leukemia cell growth rate at 10 uM concentration ChEMBL. 1738146
Control (functional) = 100 % In vitro test against L1210 murine leukemia cell growth rate at 10 uM concentration ChEMBL. 1738146

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

1 literature reference was collected for this gene.

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