Detailed information for compound 352476

Basic information

Technical information
  • TDR Targets ID: 352476
  • Name: 2-[4-[5-amino-3-(ethoxymethyl)-1,2-oxazol-4-y l]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
  • MW: 384.274 | Formula: C15H14F6N2O3
  • H donors: 2 H acceptors: 2 LogP: 2.9 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOCc1noc(c1c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)N
  • InChi: 1S/C15H14F6N2O3/c1-2-25-7-10-11(12(22)26-23-10)8-3-5-9(6-4-8)13(24,14(16,17)18)15(19,20)21/h3-6,24H,2,7,22H2,1H3
  • InChiKey: FNNKJTYMEQTYCW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-[5-amino-3-(ethoxymethyl)isoxazol-4-yl]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol
  • 2-[4-[5-amino-3-(ethoxymethyl)-4-isoxazolyl]phenyl]-1,1,1,3,3,3-hexafluoro-2-propanol
  • 2-[4-[5-azanyl-3-(ethoxymethyl)-1,2-oxazol-4-yl]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol
  • 2-[4-[5-amino-3-(ethoxymethyl)-4-isoxazolyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
  • 2-[4-[5-amino-3-(ethoxymethyl)-1,2-oxazol-4-yl]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens malonyl-CoA decarboxylase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative Get druggable targets OG5_131397 All targets in OG5_131397
Leishmania major malonyl-coa decarboxylase-like protein Get druggable targets OG5_131397 All targets in OG5_131397
Leishmania mexicana malonyl-coa decarboxylase-like protein Get druggable targets OG5_131397 All targets in OG5_131397
Leishmania braziliensis malonyl-coa decarboxylase-like protein Get druggable targets OG5_131397 All targets in OG5_131397
Trypanosoma brucei gambiense malonyl-CoA decarboxylase, mitochondrial precursor, putative Get druggable targets OG5_131397 All targets in OG5_131397
Brugia malayi putative malonyl-CoA decarboxylase Get druggable targets OG5_131397 All targets in OG5_131397
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative Get druggable targets OG5_131397 All targets in OG5_131397
Wolbachia endosymbiont of Brugia malayi malonyl-CoA decarboxylase Get druggable targets OG5_131397 All targets in OG5_131397
Leishmania donovani malonyl-coa decarboxylase-like protein Get druggable targets OG5_131397 All targets in OG5_131397
Trypanosoma brucei malonyl-CoA decarboxylase, mitochondrial precursor, putative Get druggable targets OG5_131397 All targets in OG5_131397
Trypanosoma congolense malonyl-CoA decarboxylase, mitochondrial precursor, putative Get druggable targets OG5_131397 All targets in OG5_131397
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131397 All targets in OG5_131397
Leishmania infantum malonyl-coa decarboxylase-like protein Get druggable targets OG5_131397 All targets in OG5_131397
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
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Echinococcus multilocularis snurportin 1 0.0323 0.632 0.746
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0061 0.1014 0.2587
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0012 0.0011 0.0013
Brugia malayi hypothetical protein 0.0017 0.0122 0.0122
Schistosoma mansoni cpg binding protein 0.0032 0.0421 0.0497
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0053 0.0859 0.2265
Onchocerca volvulus 0.0028 0.0349 0.0724
Trypanosoma cruzi transcription factor btf3, putative 0.0037 0.0519 0.1266
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0198 0.3793 1
Entamoeba histolytica hypothetical protein 0.0012 0.0018 0.0352
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0015 0.0082 0.0171
Echinococcus granulosus single minded 2 0.0038 0.0541 0.0639
Loa Loa (eye worm) hypothetical protein 0.0031 0.0396 0.0396
Brugia malayi chromobox protein homolog 3 0.0041 0.0606 0.0606
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0012 0.0016 0.0301
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Echinococcus multilocularis cysteine protease 0.0018 0.0132 0.0156
Loa Loa (eye worm) jmjC domain-containing protein 0.0039 0.0561 0.0561
Brugia malayi Pre-SET motif family protein 0.0032 0.0424 0.0424
Loa Loa (eye worm) hypothetical protein 0.003 0.0389 0.0389
Plasmodium vivax vivapain-2 0.0018 0.0132 0.2539
Mycobacterium leprae Possible regulatory protein 0.0013 0.0045 0.5
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0018 0.0352
Loa Loa (eye worm) hypothetical protein 0.0504 1 1
Onchocerca volvulus 0.0013 0.0045 0.0092
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Brugia malayi PAS domain containing protein 0.0051 0.081 0.081
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0859 0.1781
Echinococcus multilocularis mitogen activated protein kinase 0.0053 0.0859 0.1014
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0053 0.0859 0.2173
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0396 0.0467
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0016 0.0019
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0859 0.1014
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Loa Loa (eye worm) hypothetical protein 0.0171 0.3245 0.3245
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0219 0.4214 0.4214
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0053 0.0859 0.1773
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Schistosoma mansoni eyes absent homolog 0.0092 0.1649 0.1947
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0348
Onchocerca volvulus 0.0012 0.0014 0.0029
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0132 0.0156
Leishmania major GTP-binding protein, putative 0.0022 0.0227 0.0598
Schistosoma mansoni hypothetical protein 0.0429 0.8471 1
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0312 0.0238
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0424 0.4434
Loa Loa (eye worm) hypothetical protein 0.0013 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0092 0.1649 0.1649
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0014 0.0054 0.0026
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0053 0.0062
Echinococcus granulosus chromobox protein 1 0.0073 0.1257 0.1484
Brugia malayi Valyl-tRNA synthetase 0.0012 0.0018 0.0018
Onchocerca volvulus 0.0018 0.0132 0.0273
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0018 0.0038
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0013 0.0045 0.0092
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0045 0.0092
Brugia malayi SET domain containing protein 0.0014 0.0055 0.0055
Onchocerca volvulus 0.0018 0.0132 0.0273
Echinococcus granulosus geminin 0.0178 0.3378 0.3988
Brugia malayi M-phase phosphoprotein, mpp8 0.0012 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0041 0.0606 0.0606
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0026 0.0312 0.0312
Loa Loa (eye worm) CXXC zinc finger family protein 0.003 0.0386 0.0386
Onchocerca volvulus 0.0018 0.0132 0.0273
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Echinococcus granulosus snurportin 1 0.0323 0.632 0.746
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.01 0.1806 0.2132
Echinococcus multilocularis peregrin 0.0031 0.0396 0.0467
Echinococcus granulosus cathepsin l1 0.0018 0.0132 0.0156
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0227 0.0487
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0053 0.0859 0.2173
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0364 0.0754
Loa Loa (eye worm) hypoxia-induced factor 1 0.0158 0.2977 0.2977
Trichomonas vaginalis chromobox protein, putative 0.0044 0.0669 0.1387
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0014 0.0054 0.0026
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0013 0.0045 0.0092
Schistosoma mansoni chromobox protein 0.0012 0.0018 0.0022
Brugia malayi PHD-finger family protein 0.0012 0.0013 0.0013
Trypanosoma cruzi cysteine peptidase, putative 0.0018 0.0132 0.0233
Echinococcus granulosus cathepsin l cysteine peptidase 0.0018 0.0132 0.0156
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0053 0.0062
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.01 0.1806 0.2132
Echinococcus granulosus cathepsin l1 0.0012 0.0014 0.0017
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0018 0.0352
Echinococcus granulosus transcription factor btf3 0.0037 0.0519 0.0613
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0013 0.0045 0.0045
Brugia malayi hypothetical protein 0.0092 0.1649 0.1649
Trypanosoma cruzi cysteine peptidase, putative 0.0067 0.1132 0.2901
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Echinococcus granulosus lamin 0.0028 0.0349 0.0412
Echinococcus multilocularis Chromobox protein 3 0.0012 0.0018 0.0022
Echinococcus multilocularis chromobox protein 2 0.0012 0.0018 0.0022
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0053 0.0859 0.2265
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0018 0.0038
Schistosoma mansoni hypothetical protein 0.0323 0.632 0.746
Brugia malayi hypothetical protein 0.0026 0.0312 0.0312
Onchocerca volvulus 0.0018 0.0132 0.0273
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0157 0.0325
Brugia malayi intermediate filament protein 0.0028 0.0349 0.0349
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0032 0.0424 0.05
Echinococcus multilocularis lamin 0.0028 0.0349 0.0412
Schistosoma mansoni transcription factor btf3 0.0037 0.0519 0.0613
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Echinococcus granulosus mitogen activated protein kinase 0.0053 0.0859 0.1014
Loa Loa (eye worm) helicase 0.0012 0.0018 0.0018
Schistosoma mansoni hypothetical protein 0.0031 0.0396 0.0467
Brugia malayi CHD4 protein 0.0014 0.0053 0.0053
Leishmania major hypothetical protein, conserved 0.0026 0.0312 0.0822
Trypanosoma cruzi cruzipain precursor, putative 0.0067 0.1132 0.2901
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0312 0.6004
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0045 0.0092
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0859 0.1781
Brugia malayi hypoxia-induced factor 1 0.0158 0.2977 0.2977
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0018 0.0132 0.0273
Brugia malayi F/Y-rich N-terminus family protein 0.002 0.0188 0.0188
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0227 0.0227
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0013 0.0045 0.0053
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0083 0.0083
Trichomonas vaginalis hypothetical protein 0.0012 0.0018 0.0038
Onchocerca volvulus 0.0012 0.0018 0.0038
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0396 0.0467
Brugia malayi Importin beta-1 subunit 0.003 0.0389 0.0389
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Onchocerca volvulus 0.0028 0.0349 0.0724
Loa Loa (eye worm) heterochromatin protein 1 0.0073 0.1257 0.1257
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0227 0.0268
Loa Loa (eye worm) CHromoDomain protein family member 0.0014 0.0053 0.0053
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0092 0.0192
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0227 0.0268
Loa Loa (eye worm) hypothetical protein 0.0013 0.0042 0.0042
Schistosoma mansoni hypothetical protein 0.0054 0.0875 0.1033
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0013 0.0045 0.0092
Brugia malayi CXXC zinc finger family protein 0.003 0.0386 0.0386
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0227 0.0487
Schistosoma mansoni cpg binding protein 0.003 0.0386 0.0456
Onchocerca volvulus 0.0249 0.4825 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0018 0.0132 0.0156
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0859 0.1781
Loa Loa (eye worm) hypothetical protein 0.0032 0.0424 0.0424
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0859 0.1781
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0323 0.632 0.632
Schistosoma mansoni ran 0.0022 0.0227 0.0268
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Echinococcus multilocularis Chromo domain 0.0012 0.0018 0.0022
Leishmania major cathepsin L-like protease 0.0067 0.1132 0.2985
Trypanosoma brucei malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0198 0.3793 1
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0519 0.1076
Plasmodium falciparum basic transcription factor 3b, putative 0.0037 0.0519 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0045 0.0045
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0519 0.1076
Plasmodium falciparum importin beta, putative 0.003 0.0389 0.749
Schistosoma mansoni hypothetical protein 0.0178 0.3378 0.3988
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.0956 1
Schistosoma mansoni chromobox protein 0.0073 0.1257 0.1484
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Plasmodium vivax heterochromatin protein 1, putative 0.0012 0.0018 0.0352
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0013 0.0045 0.0118
Leishmania major protein kinase, putative 0.0014 0.0054 0.0143
Loa Loa (eye worm) hypothetical protein 0.0012 0.0013 0.0013
Onchocerca volvulus Cathepsin L homolog 0.0018 0.0132 0.0273
Echinococcus multilocularis musashi 0.0028 0.0349 0.0412
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0273 0.0566
Brugia malayi Cathepsin L-like precursor 0.0012 0.0014 0.0014
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0018 0.0132 0.2539
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0044 0.0666 0.0786
Trichomonas vaginalis ran, putative 0.0022 0.0227 0.047
Mycobacterium ulcerans putative regulatory protein 0.0038 0.0541 0.5
Brugia malayi Associated with TFs and helicases family protein 0.0012 0.0018 0.0018
Echinococcus granulosus cpg binding protein 0.0032 0.0421 0.0497
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0561 0.0662
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0561 0.0662
Onchocerca volvulus 0.0018 0.0132 0.0273
Schistosoma mansoni single-minded 0.0051 0.081 0.0956
Toxoplasma gondii NAC domain-containing protein 0.0037 0.0519 0.5431
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0312 0.3261
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0018 0.0352
Brugia malayi Pre-SET motif family protein 0.0219 0.4214 0.4214
Echinococcus multilocularis transfer RNA-Lys 0.0038 0.0541 0.0639
Plasmodium falciparum heterochromatin protein 1 0.0012 0.0018 0.0352
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0349 0.0349
Trichomonas vaginalis importin beta-1, putative 0.0025 0.0273 0.0566
Echinococcus granulosus importin subunit beta 1 0.003 0.0389 0.0459
Chlamydia trachomatis two component regulatory system sensor histidine kinase 0.0013 0.0045 1
Onchocerca volvulus 0.0018 0.0132 0.0273
Loa Loa (eye worm) hypothetical protein 0.0092 0.1649 0.1649
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0014 0.0054 0.0026
Echinococcus multilocularis cathepsin L cysteine protease 0.0018 0.0132 0.0156
Brugia malayi hypothetical protein 0.0171 0.3245 0.3245
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0053 0.0859 0.0859
Trichomonas vaginalis Heterochromatin protein, putative 0.0012 0.0018 0.0038
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0018 0.0038
Trichomonas vaginalis chromobox protein, putative 0.0044 0.0669 0.1387
Echinococcus granulosus lysine specific demethylase 5A 0.0039 0.0561 0.0662
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0012 0.0011 0.0013
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0312 0.6004
Brugia malayi Papain family cysteine protease containing protein 0.0018 0.0132 0.0132
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0312 0.0713
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0198 0.3793 1
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0018 0.0038
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0014 0.0053 0.0063
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0312 0.0713
Toxoplasma gondii chromodomain helicase DNA binding protein CHD1/SWI2/SNF2 0.0012 0.0018 0.0191
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0012 0.0018 0.0022
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0012 0.0014 0.0029
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0065 0.1094 0.1292
Onchocerca volvulus 0.0032 0.0427 0.0884
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0153 0.0181
Entamoeba histolytica hypothetical protein 0.0025 0.0273 0.5257
Leishmania major protein kinase, putative 0.0014 0.0054 0.0143
Echinococcus multilocularis cysteine protease 0.0018 0.0132 0.0156
Schistosoma mansoni hypothetical protein 0.0178 0.3378 0.3988
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0424 0.05
Onchocerca volvulus 0.0012 0.0018 0.0038
Onchocerca volvulus 0.0018 0.0132 0.0273
Trichomonas vaginalis adenylate cyclase, putative 0.0013 0.0045 0.0092
Echinococcus multilocularis dnaJ subfamily B 0.0429 0.8471 1
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0013 0.0045 0.0053
Brugia malayi Bromodomain containing protein 0.0031 0.0396 0.0396
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0018 0.0022
Echinococcus granulosus dnaJ subfamily B 0.0429 0.8471 1
Brugia malayi jmjC domain containing protein 0.0039 0.0561 0.0561
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0022 0.0227 0.2375
Leishmania major cathepsin L-like protease 0.0067 0.1132 0.2985
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0424 0.05
Brugia malayi MAP kinase sur-1 0.0053 0.0859 0.0859
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0227 0.0227
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0389 0.0454
Plasmodium falciparum cysteine proteinase falcipain 3 0.0018 0.0132 0.2539
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0396 0.7621
Loa Loa (eye worm) hypothetical protein 0.0028 0.0339 0.0339
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0018 0.0038
Trichomonas vaginalis guanylate cyclase, putative 0.0013 0.0045 0.0092
Plasmodium vivax importin-beta 2, putative 0.003 0.0389 0.749
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0018 0.0022
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0606 0.1256
Echinococcus multilocularis mitogen activated protein kinase 3 0.0053 0.0859 0.1014
Entamoeba histolytica Ran family GTPase 0.0022 0.0227 0.4373
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Echinococcus multilocularis chromobox protein 1 0.0073 0.1257 0.1484
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0016 0.0301
Trichomonas vaginalis chromobox protein, putative 0.0073 0.1257 0.2605
Schistosoma mansoni importin beta-1 0.003 0.0389 0.0459
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0424 0.05
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0389 0.0454
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0273 0.0566
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0012 0.0018 0.0018
Echinococcus multilocularis aryl hydrocarbon receptor 0.0013 0.0045 0.0053
Echinococcus granulosus intermediate filament protein 0.0028 0.0349 0.0412
Onchocerca volvulus Cathepsin L homolog 0.0018 0.0132 0.0273
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0348
Onchocerca volvulus 0.003 0.0386 0.0801
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0424 0.05
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Brugia malayi Heterochromatin protein 1 0.0073 0.1257 0.1257
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0606 0.1256
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0018 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0018 0.0132 0.0132
Echinococcus multilocularis chromobox protein 1 0.0073 0.1257 0.1484
Echinococcus granulosus peregrin 0.0031 0.0396 0.0467
Brugia malayi cathepsin L-like precursor 0.0012 0.0014 0.0014
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0045 0.0092
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0018 0.0132 0.2539
Echinococcus multilocularis cathepsin L cysteine protease 0.0018 0.0132 0.0156
Brugia malayi hypothetical protein 0.0012 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0396 0.0396
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.0227 0.4373
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Loa Loa (eye worm) ctsf protein 0.0018 0.0132 0.0132
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Trypanosoma brucei transcription factor BTF3, putative 0.0037 0.0519 0.0819
Trichomonas vaginalis guanylate cyclase, putative 0.0013 0.0045 0.0092
Plasmodium falciparum phd finger protein, putative 0.0031 0.0396 0.7621
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0526 0.0621
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0396 0.4139
Echinococcus multilocularis transcription factor btf3 0.0037 0.0519 0.0613
Loa Loa (eye worm) hypothetical protein 0.0028 0.0349 0.0349
Loa Loa (eye worm) cysteine protease 0.0018 0.0132 0.0132
Echinococcus granulosus cathepsin L cysteine proteinase 0.0018 0.0132 0.0156
Trichomonas vaginalis set domain proteins, putative 0.0249 0.4825 1
Brugia malayi bHLH-PAS transcription factor 0.0038 0.0541 0.0541
Schistosoma mansoni cathepsin F (C01 family) 0.0018 0.0132 0.0156
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.0011 0 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Schistosoma mansoni chromobox protein 0.0012 0.0018 0.0022
Brugia malayi Cathepsin L-like precursor 0.0012 0.0014 0.0014
Trypanosoma cruzi major cysteine proteinase, putative 0.0053 0.0842 0.2127
Schistosoma mansoni hypothetical protein 0.0012 0.0016 0.0019
Entamoeba histolytica hypothetical protein 0.0012 0.0018 0.0352
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0018 0.0038
Leishmania major importin beta-1 subunit, putative 0.0025 0.0273 0.072
Trypanosoma cruzi cysteine peptidase, putative 0.0067 0.1132 0.2901
Entamoeba histolytica cysteine protease, putative 0.0018 0.0132 0.2539
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0014 0.0054 0.0026
Brugia malayi PHD-finger family protein 0.0031 0.0396 0.0396
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0638 0.0754
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0053 0.0859 0.2173
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0348
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Trypanosoma brucei protein kinase, putative 0.0053 0.0859 0.1773
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0018 0.0132 0.0273
Wolbachia endosymbiont of Brugia malayi malonyl-CoA decarboxylase 0.0504 1 0.5
Trichomonas vaginalis chromobox protein, putative 0.0073 0.1257 0.2605
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0018 0.0132 0.0156
Loa Loa (eye worm) hypothetical protein 0.0012 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0364 0.0754
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0312 0.6004
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Schistosoma mansoni cathepsin F (C01 family) 0.0012 0.0014 0.0017
Echinococcus granulosus Chromo domain 0.0012 0.0018 0.0022
Trypanosoma cruzi cysteine peptidase, putative 0.0067 0.1132 0.2901
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0396 0.4139
Plasmodium vivax vivapain-2 0.0018 0.0132 0.2539
Loa Loa (eye worm) ICD-1 protein 0.0037 0.0519 0.0519
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0387 0.0457
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0018 0.0191
Entamoeba histolytica cysteine proteinase, putative 0.0018 0.0132 0.2539
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0012 0.0014 0.0029
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0013 0.0045 0.0092
Trypanosoma cruzi transcription factor btf3, putative 0.0037 0.0519 0.1266
Brugia malayi jmjC domain containing protein 0.01 0.1806 0.1806
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Entamoeba histolytica hypothetical protein 0.0012 0.0018 0.0352
Schistosoma mansoni lamin 0.0028 0.0349 0.0412
Echinococcus granulosus aryl hydrocarbon receptor 0.0013 0.0045 0.0053
Leishmania major basic transcription factor 3a, putative 0.0037 0.0519 0.1369
Plasmodium vivax basic transcription factor 3b, putative 0.0037 0.0519 1
Echinococcus multilocularis geminin 0.0178 0.3378 0.3988
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.1056 0.1056
Plasmodium falciparum chromodomain-helicase-DNA-binding protein 1 homolog, putative 0.0012 0.0018 0.0352
Schistosoma mansoni hypothetical protein 0.0012 0.0018 0.0022
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Onchocerca volvulus 0.0038 0.0541 0.1122
Onchocerca volvulus Alhambra homolog 0.0031 0.0396 0.082
Entamoeba histolytica cysteine proteinase, putative 0.0018 0.0132 0.2539
Brugia malayi Protein cec-1. 0.0012 0.0018 0.0018
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0016 0.0019
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.0227 0.4373
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0012 0.0018 0.0352
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0349 0.0349
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.0273 0.0609
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0606 0.1256
Schistosoma mansoni intermediate filament proteins 0.0028 0.0349 0.0412
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Entamoeba histolytica hypothetical protein 0.0037 0.0519 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0016 0.0092 0.0192
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0012 0.0018 0.0022
Echinococcus multilocularis cpg binding protein 0.0032 0.0421 0.0497
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0018 0.0352
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0396 0.0467
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0389 0.4068
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Echinococcus granulosus chromobox protein 1 0.0073 0.1257 0.1484
Echinococcus granulosus lamin dm0 0.0028 0.0349 0.0412
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Loa Loa (eye worm) hypothetical protein 0.0012 0.0018 0.0018
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0053 0.0859 0.2173
Brugia malayi RNA, U transporter 1 0.0086 0.1519 0.1519
Giardia lamblia PHD finger protein 15 0.0031 0.0396 0.2668
Echinococcus granulosus mitogen activated protein kinase 3 0.0053 0.0859 0.1014
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0014 0.0053 0.0063
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0157 0.0325
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0638 0.0754
Loa Loa (eye worm) hypothetical protein 0.0032 0.0427 0.0427
Echinococcus multilocularis lamin dm0 0.0028 0.0349 0.0412
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0012 0.0018 0.0022
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0349 0.0349
Leishmania major cathepsin L-like protease 0.0067 0.1132 0.2985
Brugia malayi Cathepsin L-like cysteine proteinase 0.0012 0.0014 0.0014
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0519 0.1076
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0018 0.0132 0.0132
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0018 0.0191
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0348
Loa Loa (eye worm) fibroinase 0.0018 0.0132 0.0132
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Onchocerca volvulus 0.0044 0.0666 0.1381
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0018 0.0352
Schistosoma mansoni cpg binding protein 0.0032 0.0421 0.0497
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Plasmodium vivax SET domain protein, putative 0.0032 0.0424 0.8164
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0044 0.0669 0.1387
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0424 0.05
Brugia malayi beta-NAC-like protein 0.0037 0.0519 0.0519
Entamoeba histolytica cysteine proteinase, putative 0.0012 0.0014 0.0272
Loa Loa (eye worm) hypothetical protein 0.0052 0.0838 0.0838
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0014 0.0053 0.0063
Echinococcus granulosus chromobox protein 2 0.0012 0.0018 0.0022
Schistosoma mansoni aryl hydrocarbon receptor 0.0051 0.081 0.0956
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0053 0.0859 0.8987
Onchocerca volvulus Cathepsin F homolog 0.0018 0.0132 0.0273
Echinococcus multilocularis importin subunit beta 1 0.003 0.0389 0.0459
Schistosoma mansoni lamin 0.0028 0.0349 0.0412
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0157 0.0325
Schistosoma mansoni ran 0.0022 0.0227 0.0268
Schistosoma mansoni chromobox protein 0.0073 0.1257 0.1484
Giardia lamblia Kinase, CMGC MAPK 0.0053 0.0859 1
Echinococcus granulosus Chromobox protein 3 0.0012 0.0018 0.0022
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0018 0.0132 0.0273
Schistosoma mansoni jumonji domain containing protein 0.0079 0.1389 0.1639
Leishmania major cysteine peptidase A (CPA) 0.0018 0.0132 0.0348
Leishmania major malonyl-coa decarboxylase-like protein 0.0198 0.3793 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0018 0.0132 0.0273
Loa Loa (eye worm) hypothetical protein 0.0014 0.0053 0.0053
Brugia malayi Cathepsin L-like precursor 0.0018 0.0132 0.0132
Entamoeba histolytica transcription factor BTF3, putative 0.0037 0.0519 1
Leishmania major cathepsin L-like protease 0.0018 0.0132 0.0348
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0083 0.0083
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0013 0.0045 0.0092
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0018 0.0038
Toxoplasma gondii cathepsin CPL 0.0018 0.0132 0.1379
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0067 0.1132 0.2538

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.63 uM Inhibitory activity against recombinant human MCD MBP fusion protein ChEMBL. 16257202
IC50 (binding) = 0.63 uM Inhibitory activity against recombinant human MCD MBP fusion protein ChEMBL. 16257202

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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