Detailed information for compound 1257726

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 558.898 | Formula: C30H27Cl3FNO2
  • H donors: 1 H acceptors: 0 LogP: 8.6 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 2
  • SMILES: NCC(c1ccc(cc1F)c1ccccc1Cl)Cc1ccc(cc1)OCCOc1c(Cl)cc(cc1Cl)C
  • InChi: 1S/C30H27Cl3FNO2/c1-19-14-27(32)30(28(33)15-19)37-13-12-36-23-9-6-20(7-10-23)16-22(18-35)25-11-8-21(17-29(25)34)24-4-2-3-5-26(24)31/h2-11,14-15,17,22H,12-13,16,18,35H2,1H3
  • InChiKey: ZUNPKGJBZFDEPB-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens renin Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Echinococcus granulosus cathepsin d lysosomal aspartyl protease Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin I Get druggable targets OG5_126885 All targets in OG5_126885
Babesia bovis eukaryotic aspartyl protease family protein Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii plasmepsin Get druggable targets OG5_126885 All targets in OG5_126885
Neospora caninum Pepsinogen A1, related Get druggable targets OG5_126885 All targets in OG5_126885
Candida albicans vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin IV Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium berghei plasmepsin VI Get druggable targets OG5_126885 All targets in OG5_126885
Cryptosporidium hominis aspartyl protease precursor Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma japonicum Cathepsin D precursor, putative Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni cathepsin D (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium berghei plasmepsin IV Get druggable targets OG5_126885 All targets in OG5_126885
Cryptosporidium parvum membrane bound aspartyl proteinase with a signal peptide plus transmembrane domain Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium knowlesi plasmepsin IV, putative Get druggable targets OG5_126885 All targets in OG5_126885
Toxoplasma gondii aspartyl protease ASP1 Get druggable targets OG5_126885 All targets in OG5_126885
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium vivax plasmepsin IV, putative Get druggable targets OG5_126885 All targets in OG5_126885
Toxoplasma gondii aspartyl proteinase (eimepsin), putative Get druggable targets OG5_126885 All targets in OG5_126885
Theileria parva pepsinogen, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Theileria parva cathepsin E, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin II Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin VI Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma japonicum ko:K01379 cathepsin D [EC3.4.23.5], putative Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni cathepsin D (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) Get druggable targets OG5_126885 All targets in OG5_126885
Loa Loa (eye worm) aspartic protease BmAsp-2 Get druggable targets OG5_126885 All targets in OG5_126885
Candida albicans vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium knowlesi aspartyl protease, putative Get druggable targets OG5_126885 All targets in OG5_126885
Neospora caninum Renin, related Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium vivax aspartyl proteinase, putative Get druggable targets OG5_126885 All targets in OG5_126885

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum plasmepsin X renin 406 aa 352 aa 26.4 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Echinococcus granulosus cpg binding protein 0.0026 0.0189 0.0313
Loa Loa (eye worm) hypothetical protein 0.0021 0.0137 0.0225
Trichomonas vaginalis PIKK family atypical protein kinase 0.002 0.013 0.0187
Trypanosoma cruzi cysteine proteinase, putative 0.0013 0.005 0.021
Schistosoma mansoni hypothetical protein 0.0056 0.0526 0.0872
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0075 0.074 0.1226
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0026 0.0191 0.0316
Trichomonas vaginalis set domain proteins, putative 0.0625 0.6956 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Plasmodium vivax aspartyl proteinase, putative 0.0059 0.0565 0.7118
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0095 0.0136
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Leishmania major cathepsin L-like protease 0.0098 0.1009 1
Loa Loa (eye worm) hypothetical protein 0.0081 0.0816 0.1338
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0026 0.019 0.0311
Echinococcus granulosus cysteine protease 0.0013 0.005 0.0082
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0075 0.074 0.1226
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Echinococcus granulosus cathepsin l cysteine peptidase 0.0026 0.0191 0.0316
Leishmania major cathepsin L-like protease 0.0026 0.0191 0.1651
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0034 0.0285 0.2617
Echinococcus multilocularis PHD finger protein rhinoceros 0.0023 0.0156 0.0259
Toxoplasma gondii cathepsin CPL 0.0026 0.0191 0.0191
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0079 0.0794 0.1316
Entamoeba histolytica cysteine proteinase 2 0.0013 0.005 0.1738
Echinococcus granulosus cathepsin l1 0.0017 0.0095 0.0157
Toxoplasma gondii PHD-finger domain-containing protein 0.0023 0.0156 0.0156
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Loa Loa (eye worm) hypothetical protein 0.0056 0.0526 0.0863
Trypanosoma cruzi cysteine peptidase, putative 0.0098 0.1009 1
Echinococcus multilocularis cathepsin L 0.0013 0.005 0.0082
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0059 0.0565 0.0937
Loa Loa (eye worm) jmjC domain-containing protein 0.0047 0.043 0.0704
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Echinococcus multilocularis lamin 0.0021 0.0137 0.0227
Toxoplasma gondii aspartyl protease 0.0014 0.0057 0.0057
Schistosoma mansoni cpg binding protein 0.0026 0.0189 0.0313
Trypanosoma cruzi cruzipain precursor, putative 0.0098 0.1009 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Trichomonas vaginalis chromobox protein, putative 0.0033 0.027 0.0388
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0034 0.0285 0.0473
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0054 0.0512 0.0849
Onchocerca volvulus 0.0026 0.0191 0.0274
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Leishmania major cathepsin L-like protease 0.0098 0.1009 1
Echinococcus granulosus chromobox protein 1 0.0054 0.0513 0.085
Toxoplasma gondii aspartyl protease ASP1 0.0059 0.0565 0.0565
Echinococcus granulosus dnaJ subfamily B 0.0345 0.3795 0.6285
Loa Loa (eye worm) hypothetical protein 0.0026 0.019 0.0311
Schistosoma mansoni tar DNA-binding protein 0.0136 0.1437 0.2381
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Onchocerca volvulus Cathepsin F homolog 0.0026 0.0191 0.0274
Plasmodium falciparum plasmepsin VIII, putative 0.0014 0.0057 0.1008
Entamoeba histolytica cysteine proteinase, putative 0.0026 0.0191 0.6684
Echinococcus multilocularis cathepsin L cysteine protease 0.0026 0.0191 0.0316
Onchocerca volvulus 0.0026 0.0191 0.0274
Loa Loa (eye worm) hypothetical protein 0.001 0.0014 0.0023
Onchocerca volvulus Alhambra homolog 0.0023 0.0156 0.0225
Echinococcus multilocularis chromobox protein 1 0.0054 0.0513 0.085
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0034 0.0285 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0011 0.0029 0.0042
Brugia malayi aspartic protease BmAsp-1, identical 0.0014 0.0057 0.0093
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0026 0.0191 0.3376
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0207 0.0297
Plasmodium vivax plasmepsin IV, putative 0.0059 0.0565 0.7118
Loa Loa (eye worm) TAR-binding protein 0.0136 0.1437 0.2356
Entamoeba histolytica cysteine proteinase, putative 0.0013 0.005 0.1738
Loa Loa (eye worm) hypothetical protein 0.0014 0.0057 0.0093
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0079 0.0794 0.1316
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0013 0.005 0.0071
Loa Loa (eye worm) histone methyltransferase 0.001 0.0017 0.0028
Schistosoma mansoni tar DNA-binding protein 0.0136 0.1437 0.2381
Trypanosoma cruzi cysteine peptidase, putative 0.0098 0.1009 1
Schistosoma mansoni chromobox protein 0.0054 0.0513 0.085
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0029 0.0041
Loa Loa (eye worm) hypothetical protein 0.0017 0.0095 0.0155
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0285 0.041
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0243 0.035
Onchocerca volvulus 0.0088 0.0894 0.1286
Brugia malayi chromobox protein homolog 3 0.003 0.0243 0.0399
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0013 0.005 0.021
Brugia malayi Pre-SET motif family protein 0.055 0.61 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0027 0.0207 0.1814
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0026 0.019 0.0314
Schistosoma mansoni hypothetical protein 0.0026 0.019 0.0314
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Onchocerca volvulus 0.0026 0.0191 0.0274
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.1862 0.3086
Plasmodium vivax vivapain-3 0.0013 0.005 0.0625
Echinococcus multilocularis jumonji domain containing protein 0.0032 0.0257 0.0425
Schistosoma mansoni intermediate filament proteins 0.0021 0.0137 0.0227
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0011 0.0029 0.0048
Plasmodium vivax plasmepsin V, putative 0.0014 0.0057 0.0717
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Trypanosoma cruzi cysteine peptidase, putative 0.0013 0.005 0.021
Plasmodium falciparum cysteine proteinase falcipain 1 0.0013 0.005 0.0878
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0011 0.0029 0.0048
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Schistosoma mansoni lamin 0.0021 0.0137 0.0227
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0079 0.0794 0.1315
Echinococcus granulosus lamin 0.0021 0.0137 0.0227
Brugia malayi latrophilin 2 splice variant baaae 0.0056 0.0526 0.0863
Echinococcus granulosus chromobox protein 1 0.0054 0.0513 0.085
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0079 0.0794 0.0794
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Loa Loa (eye worm) phosphatidylinositol 3 0.0034 0.0285 0.0468
Onchocerca volvulus 0.0021 0.0137 0.0197
Onchocerca volvulus Cathepsin L homolog 0.0026 0.0191 0.0274
Echinococcus granulosus cathepsin L 0.0013 0.005 0.0082
Trypanosoma cruzi cysteine peptidase, putative 0.0098 0.1009 1
Plasmodium vivax SET domain protein, putative 0.0079 0.0794 1
Onchocerca volvulus 0.0021 0.0137 0.0197
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Plasmodium falciparum plasmepsin IX 0.0014 0.0057 0.1008
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0026 0.0191 0.0313
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0143 0.0206
Trichomonas vaginalis PIKK family atypical protein kinase 0.002 0.0128 0.0184
Echinococcus granulosus cathepsin L cysteine protease 0.0013 0.005 0.0082
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Plasmodium falciparum plasmepsin V 0.0014 0.0057 0.1008
Trichomonas vaginalis PIKK family atypical protein kinase 0.0011 0.0029 0.0042
Brugia malayi SET domain containing protein 0.0012 0.0039 0.0063
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0016 0.0084 0.0139
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Loa Loa (eye worm) heterochromatin protein 1 0.0054 0.0513 0.0841
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0013 0.005 0.0071
Plasmodium falciparum plasmepsin III 0.0014 0.0057 0.1008
Onchocerca volvulus Heterochromatin protein 1 homolog 0.003 0.0243 0.035
Echinococcus granulosus microtubule associated protein 2 0.0544 0.6034 0.9993
Echinococcus multilocularis musashi 0.0021 0.0137 0.0227
Plasmodium vivax vivapain-2 0.0026 0.0191 0.2403
Loa Loa (eye worm) hypothetical protein 0.008 0.0798 0.1308
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0017 0.0028
Echinococcus granulosus jumonji domain containing protein 0.0032 0.0257 0.0425
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Trichomonas vaginalis PIKK family atypical protein kinase 0.0023 0.0158 0.0228
Trypanosoma cruzi target of rapamycin kinase 3 0.0027 0.0207 0.1814
Echinococcus granulosus intermediate filament protein 0.0021 0.0137 0.0227
Mycobacterium ulcerans pantoate--beta-alanine ligase 0.0895 1 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0169 0.0277
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0207 0.0297
Onchocerca volvulus 0.008 0.0798 0.1147
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Brugia malayi Intermediate filament tail domain containing protein 0.0021 0.0137 0.0225
Echinococcus multilocularis tumor protein p63 0.0544 0.6038 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Plasmodium vivax aspartyl protease, putative 0.0014 0.0057 0.0717
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.015 0.0216
Plasmodium vivax vivapain-1 0.0013 0.005 0.0625
Trichomonas vaginalis chromobox protein, putative 0.0054 0.0513 0.0738
Echinococcus multilocularis Chromobox protein 3 0.0009 0.000000037215 0.000000061633
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Brugia malayi Pre-SET motif family protein 0.0079 0.0794 0.1302
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0013 0.005 0.0082
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Plasmodium falciparum plasmepsin IV 0.0059 0.0565 1
Brugia malayi Latrophilin receptor protein 2 0.0026 0.019 0.0311
Brugia malayi Cathepsin L-like cysteine proteinase 0.0017 0.0095 0.0155
Brugia malayi Papain family cysteine protease containing protein 0.0026 0.0191 0.0313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0207 0.0297
Echinococcus multilocularis lamin dm0 0.0021 0.0137 0.0227
Brugia malayi CHD4 protein 0.001 0.0016 0.0026
Brugia malayi hypothetical protein 0.0014 0.0057 0.0093
Loa Loa (eye worm) hypothetical protein 0.0021 0.0133 0.0218
Trypanosoma cruzi cysteine protease, putative 0.0013 0.005 0.021
Entamoeba histolytica cysteine proteinase 1, putative 0.0013 0.005 0.1738
Brugia malayi Eukaryotic aspartyl protease family protein 0.0014 0.0057 0.0093
Leishmania major cathepsin L-like protease 0.0026 0.0191 0.1651
Echinococcus multilocularis chromobox protein 1 0.0054 0.0513 0.085
Echinococcus multilocularis GPCR, family 2 0.0026 0.019 0.0314
Schistosoma mansoni hypothetical protein 0.0026 0.019 0.0314
Trichomonas vaginalis PIKK family atypical protein kinase 0.0011 0.0029 0.0042
Echinococcus multilocularis cpg binding protein 0.0026 0.0189 0.0313
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0152 0.1619 0.2327
Schistosoma mansoni cpg binding protein 0.0026 0.0189 0.0313
Echinococcus granulosus cytoplasmic intermediate filament protein 0.001 0.0014 0.0024
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0059 0.0565 0.0565
Brugia malayi cytoplasmic intermediate filament protein 0.0011 0.0027 0.0044
Echinococcus granulosus PHD finger protein rhinoceros 0.0023 0.0156 0.0259
Echinococcus multilocularis peregrin 0.0023 0.0156 0.0259
Brugia malayi Pepsin A precursor 0.0014 0.0057 0.0093
Schistosoma mansoni tar DNA-binding protein 0.0136 0.1437 0.2381
Loa Loa (eye worm) phosphatidylinositol 3 0.0011 0.0029 0.0048
Brugia malayi Papain family cysteine protease containing protein 0.0013 0.005 0.0081
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Plasmodium falciparum cysteine proteinase falcipain 3 0.0026 0.0191 0.3376
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0285 0.041
Brugia malayi aspartic protease BmAsp-2, identical 0.0014 0.0057 0.0093
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0034 0.0285 0.2617
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0026 0.019 0.0314
Brugia malayi CXXC zinc finger family protein 0.0024 0.0173 0.0284
Echinococcus multilocularis dnaJ subfamily B 0.0345 0.3795 0.6285
Schistosoma mansoni lamin 0.0021 0.0137 0.0227
Loa Loa (eye worm) hypothetical protein 0.0017 0.0095 0.0155
Schistosoma mansoni microtubule-associated protein tau 0.0544 0.6034 1
Plasmodium vivax aspartyl proteinase, putative 0.0014 0.0057 0.0717
Echinococcus multilocularis cysteine protease 0.0026 0.0191 0.0316
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Entamoeba histolytica cysteine proteinase, putative 0.0013 0.005 0.1738
Onchocerca volvulus 0.0017 0.0095 0.0136
Leishmania major cathepsin L-like protease 0.0026 0.0191 0.1651
Schistosoma mansoni hypothetical protein 0.0026 0.019 0.0314
Entamoeba histolytica cysteine proteinase, putative 0.0017 0.0095 0.3311
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0013 0.005 0.0082
Brugia malayi N-terminal motif family protein 0.0152 0.1619 0.2654
Plasmodium vivax aspartyl protease, putative 0.0014 0.0057 0.0717
Trypanosoma cruzi major cysteine proteinase, putative 0.0077 0.0772 0.7577
Schistosoma mansoni chromobox protein 0.0054 0.0513 0.085
Plasmodium falciparum plasmepsin X 0.0014 0.0057 0.1008
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0011 0.0029 0.0048
Brugia malayi cathepsin L-like precursor 0.0017 0.0095 0.0155
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0243 0.0399
Plasmodium falciparum plasmepsin II 0.0059 0.0565 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0095 0.0155
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni hypothetical protein 0.0345 0.3795 0.629
Trichomonas vaginalis conserved hypothetical protein 0.003 0.0243 0.035
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0026 0.0191 0.0274
Loa Loa (eye worm) MH2 domain-containing protein 0.0101 0.1034 0.1695
Onchocerca volvulus 0.0014 0.0057 0.0082
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0026 0.019 0.0314
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0034 0.0285 1
Onchocerca volvulus 0.0024 0.0169 0.0243
Brugia malayi jmjC domain containing protein 0.0029 0.0226 0.037
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0156 0.0256
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0013 0.005 0.0082
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0136 0.1437 0.2356
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni cellular tumor antigen P53 0.008 0.0798 0.1323
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0014 0.0062 0.0089
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.009 0.0913 0.9018
Leishmania major cathepsin L-like protease 0.0098 0.1009 1
Leishmania major cathepsin L-like protease 0.0026 0.0191 0.1651
Trichomonas vaginalis chromobox protein, putative 0.0033 0.027 0.0388
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.1862 0.3086
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0011 0.0029 0.0048
Entamoeba histolytica cysteine proteinase, putative 0.0013 0.005 0.1738
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Giardia lamblia GTOR 0.0034 0.0285 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.002 0.013 0.0187
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0034 0.0285 0.2617
Trichomonas vaginalis PIKK family atypical protein kinase 0.002 0.013 0.0187
Onchocerca volvulus 0.0026 0.0191 0.0274
Mycobacterium tuberculosis Pantoate--beta-alanine ligase PanC (pantothenate synthetase) (pantoate activating enzyme) 0.0895 1 0.5
Loa Loa (eye worm) ctsf protein 0.0026 0.0191 0.0313
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0011 0.0027 0.0044
Loa Loa (eye worm) hypothetical protein 0.001 0.001 0.0016
Plasmodium falciparum phd finger protein, putative 0.0023 0.0156 0.2766
Toxoplasma gondii PHD-finger domain-containing protein 0.0023 0.0156 0.0156
Echinococcus multilocularis lysine specific demethylase 5A 0.0028 0.021 0.0348
Loa Loa (eye worm) hypothetical protein 0.0152 0.1619 0.2654
Plasmodium falciparum plasmepsin VII 0.0014 0.0057 0.1008
Loa Loa (eye worm) aspartyl protease 6 0.0014 0.0057 0.0093
Echinococcus multilocularis cathepsin L cysteine protease 0.0026 0.0191 0.0316
Leishmania major cathepsin L-like protease 0.0026 0.0191 0.1651
Schistosoma mansoni hypothetical protein 0.0023 0.0156 0.0259
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.001 0.0016 0.0026
Echinococcus multilocularis cysteine protease 0.0026 0.0191 0.0316
Echinococcus granulosus peregrin 0.0023 0.0156 0.0259
Trichomonas vaginalis PIKK family atypical protein kinase 0.0034 0.0285 0.041
Schistosoma mansoni hypothetical protein 0.0026 0.019 0.0314
Schistosoma mansoni jumonji/arid domain-containing protein 0.0029 0.0226 0.0374
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0059 0.0565 0.0936
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Brugia malayi TAR-binding protein 0.0136 0.1437 0.2356
Schistosoma mansoni jumonji domain containing protein 0.0059 0.0568 0.0941
Brugia malayi intermediate filament protein 0.0021 0.0137 0.0225
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0026 0.0191 0.0316
Plasmodium falciparum plasmepsin I 0.0059 0.0565 1
Plasmodium vivax hypothetical protein, conserved 0.0023 0.0156 0.1969
Brugia malayi Calcitonin receptor-like protein seb-1 0.0081 0.0816 0.1338
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0033 0.027 0.0388
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0076 0.0755 0.1251
Echinococcus granulosus GPCR family 2 0.0026 0.019 0.0314
Entamoeba histolytica cysteine protease, putative 0.0026 0.0191 0.6684
Onchocerca volvulus 0.0625 0.6956 1
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0034 0.0285 0.0473
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0229 0.0329
Toxoplasma gondii aspartyl protease ASP3 0.0014 0.0057 0.0057
Loa Loa (eye worm) CHromoDomain protein family member 0.001 0.0016 0.0026
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Schistosoma mansoni tar DNA-binding protein 0.0136 0.1437 0.2381
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0029 0.0226 0.0374
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0034 0.0285 0.0473
Schistosoma mansoni cpg binding protein 0.0024 0.0173 0.0287
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Loa Loa (eye worm) hypothetical protein 0.0014 0.0057 0.0093
Schistosoma mansoni chromodomain helicase DNA binding protein 0.001 0.0016 0.0026
Brugia malayi PHD-finger family protein 0.0023 0.0156 0.0256
Onchocerca volvulus 0.0024 0.0173 0.0249
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0033 0.0048
Plasmodium vivax aspartyl protease, putative 0.0014 0.0057 0.0717
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0013 0.005 0.021
Toxoplasma gondii pantoate-beta-alanine ligase 0.0895 1 1
Brugia malayi Papain family cysteine protease containing protein 0.0013 0.005 0.0081
Trichomonas vaginalis PIKK family atypical protein kinase 0.0011 0.0029 0.0042
Plasmodium falciparum conserved Plasmodium membrane protein, unknown function 0.0009 0 0.0003
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0026 0.0191 0.0313
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0034 0.0285 0.2617
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0088 0.0894 0.1482
Loa Loa (eye worm) hypothetical protein 0.0023 0.0156 0.0256
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.055 0.61 1
Onchocerca volvulus 0.0009 0.000000037215 0.000000053503
Trichomonas vaginalis PIKK family atypical protein kinase 0.002 0.0128 0.0184
Brugia malayi MH2 domain containing protein 0.0101 0.1034 0.1695
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Leishmania major cysteine peptidase A (CPA) 0.0026 0.0191 0.1651
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0207 0.0297
Loa Loa (eye worm) fibroinase 0.0026 0.0191 0.0313
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0023 0.0156 0.0259
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0081 0.0816 0.1338
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0027 0.0207 0.1814
Trypanosoma cruzi cysteine proteinase, putative 0.0013 0.005 0.021
Schistosoma mansoni cathepsin F (C01 family) 0.0026 0.0191 0.0316
Loa Loa (eye worm) intermediate filament protein 0.0021 0.0137 0.0225
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0143 0.0206
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.001 0.0016 0.0026
Onchocerca volvulus 0.0014 0.0057 0.0082
Echinococcus granulosus cathepsin l1 0.0026 0.0191 0.0316
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Brugia malayi F/Y-rich N-terminus family protein 0.0018 0.01 0.0163
Echinococcus granulosus cathepsin L cysteine proteinase 0.0026 0.0191 0.0316
Toxoplasma gondii target of rapamycin (TOR), putative 0.0025 0.0187 0.0187
Plasmodium vivax hypothetical protein, conserved 0.0009 0 0.0002
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0034 0.0285 0.2617
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Schistosoma mansoni memapsin-2 (A01 family) 0.0014 0.0057 0.0094
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0033 0.0048
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Loa Loa (eye worm) hypothetical protein 0.0059 0.0565 0.0927
Entamoeba histolytica cysteine proteinase, putative 0.0013 0.005 0.1738
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0079 0.0794 0.1316
Entamoeba histolytica cysteine proteinase, putative 0.0026 0.0191 0.6684
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Loa Loa (eye worm) hypothetical protein 0.001 0.001 0.0016
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Trypanosoma cruzi cysteine peptidase, putative 0.0026 0.0191 0.1651
Echinococcus granulosus tar DNA binding protein 0.0136 0.1437 0.238
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0108 0.0155
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0098 0.1009 1
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Onchocerca volvulus 0.0026 0.0191 0.0274
Brugia malayi Cathepsin L-like precursor 0.0017 0.0095 0.0155
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0081 0.0816 0.1338
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0095 0.0157
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0059 0.0565 0.0813
Brugia malayi RNA binding protein 0.0136 0.1437 0.2356
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0059 0.0565 0.0927
Echinococcus granulosus lysine specific demethylase 5A 0.0029 0.0226 0.0374
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0016 0.0082 0.0542
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0057 0.0094
Trichomonas vaginalis chromobox protein, putative 0.0054 0.0513 0.0738
Brugia malayi jmjC domain containing protein 0.0075 0.074 0.1214
Trichomonas vaginalis PIKK family atypical protein kinase 0.0011 0.0029 0.0042
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Loa Loa (eye worm) hypothetical protein 0.0026 0.0191 0.0313
Echinococcus granulosus Chromobox protein 3 0.0009 0.000000037215 0.000000061633
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0034 0.0285 0.2617
Loa Loa (eye worm) cysteine protease 0.0026 0.0191 0.0313
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0034 0.0285 0.0468
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Plasmodium falciparum plasmepsin VI 0.0059 0.0565 1
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0014 0.006 0.0315
Onchocerca volvulus 0.0026 0.0191 0.0274
Loa Loa (eye worm) transcription factor SMAD2 0.0101 0.1034 0.1695
Brugia malayi RNA recognition motif domain containing protein 0.0136 0.1437 0.2356
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0026 0.0191 0.3376
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0017 0.0028
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0062 0.0089
Plasmodium vivax vivapain-2 0.0026 0.0191 0.2403
Trichomonas vaginalis PIKK family atypical protein kinase 0.0009 0.0003 0.0004
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0014 0.0057 0.0057
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0014 0.0057 0.0093
Echinococcus granulosus tumor protein p63 0.0544 0.6038 1
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0059 0.0565 0.0936
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Loa Loa (eye worm) hypothetical protein 0.0079 0.0794 0.1302
Echinococcus granulosus lamin dm0 0.0021 0.0137 0.0227
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0095 0.0136
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0079 0.0794 0.1315
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Toxoplasma gondii histone lysine methyltransferase SET1 0.0049 0.045 0.045
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0026 0.0191 0.0274
Schistosoma mansoni cathepsin F (C01 family) 0.0026 0.0191 0.0316
Plasmodium vivax unspecified product 0.0013 0.005 0.0625
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0013 0.005 0.021
Echinococcus granulosus histone lysine methyltransferase setb 0.0079 0.0794 0.1315
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0014 0.0062 0.0089
Echinococcus multilocularis microtubule associated protein 2 0.0544 0.6034 0.9993
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0187 0.0268
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.001 0.0014 0.0024
Loa Loa (eye worm) CXXC zinc finger family protein 0.0024 0.0173 0.0284
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0026 0.019 0.0311
Brugia malayi Heterochromatin protein 1 0.0054 0.0513 0.0841
Loa Loa (eye worm) hypothetical protein 0.0017 0.0095 0.0155
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0026 0.019 0.0314
Onchocerca volvulus Cathepsin L homolog 0.0026 0.0191 0.0274
Loa Loa (eye worm) hypothetical protein 0.0039 0.034 0.0557
Entamoeba histolytica cysteine protease, putative 0.0013 0.005 0.1738
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0021 0.0137 0.0225
Brugia malayi Cathepsin L-like precursor 0.0026 0.0191 0.0313
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0207 0.0297
Loa Loa (eye worm) jmjC domain-containing protein 0.0029 0.0226 0.037
Brugia malayi hypothetical protein 0.0014 0.0057 0.0093
Schistosoma mansoni tar DNA-binding protein 0.0136 0.1437 0.2381
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274
Onchocerca volvulus 0.0026 0.0191 0.0274
Brugia malayi Bromodomain containing protein 0.0023 0.0156 0.0256
Echinococcus multilocularis tar DNA binding protein 0.0136 0.1437 0.238
Loa Loa (eye worm) RNA binding protein 0.0136 0.1437 0.2356
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0026 0.0191 0.0274

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 7 nM Inhibition of human recombinant renin in phosphate buffer ChEMBL. 20728350
IC50 (binding) = 1151 nM Inhibition of human recombinant renin in plasma ChEMBL. 20728350

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.