Detailed information for compound 60854

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 861.025 | Formula: C48H62F2N4O8
  • H donors: 4 H acceptors: 6 LogP: 9.28 Rotable bonds: 29
    Rule of 5 violations (Lipinski): 2
  • SMILES: COC(=O)[C@H](Cc1ccccc1)/C=C/[C@@H](NC(=O)C(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)Cc1ccccc1)Cc1ccccc1)CC(C)C)(F)F)CC(C)C
  • InChi: 1S/C48H62F2N4O8/c1-31(2)26-37(25-24-36(44(58)61-8)28-33-18-12-9-13-19-33)51-45(59)48(49,50)41(55)38(27-32(3)4)52-42(56)39(29-34-20-14-10-15-21-34)53-43(57)40(30-35-22-16-11-17-23-35)54-46(60)62-47(5,6)7/h9-25,31-32,36-40H,26-30H2,1-8H3,(H,51,59)(H,52,56)(H,53,57)(H,54,60)/b25-24+/t36-,37+,38-,39-,40-/m0/s1
  • InChiKey: AUXGYUOGBSTLSL-VBESFQFHSA-N  


Substructure search Similarity search

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
Plasmodium vivax plasmepsin IV, 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
Neospora caninum Pepsinogen A1, related 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 knowlesi aspartyl protease, putative 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
Schistosoma japonicum Cathepsin D precursor, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin VI 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
Schistosoma japonicum ko:K01379 cathepsin D [EC3.4.23.5], putative 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
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
Cryptosporidium hominis aspartyl protease precursor 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
Candida albicans vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C) 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin I Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium berghei plasmepsin IV 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 falciparum plasmepsin II 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
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Neospora caninum Renin, related 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
Theileria parva cathepsin E, 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
Plasmodium vivax aspartyl proteinase, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii plasmepsin Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii hypothetical protein 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
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
Leishmania major cathepsin L-like protease 0.0017 0.0025 0.0863
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Loa Loa (eye worm) hypothetical protein 0.0042 0.0141 0.1391
Echinococcus granulosus lamin 0.0027 0.0072 0.0072
Loa Loa (eye worm) CYP4Cod1 0.0012 0.0005 0.0049
Brugia malayi hypothetical protein 0.0231 0.1014 1
Echinococcus multilocularis lamin dm0 0.0027 0.0072 0.0064
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0059 0.0221 0.2182
Echinococcus multilocularis jun protein 0.0082 0.0327 0.0319
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0063 0.2365
Brugia malayi hypothetical protein 0.0016 0.0022 0.022
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.0752 0.2433
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0072 0.0707
Loa Loa (eye worm) transcription factor SMAD2 0.0117 0.0487 0.48
Echinococcus multilocularis lamin 0.0027 0.0072 0.0064
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0025 0.0017
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.0218 0.0218
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Leishmania major cysteine peptidase A (CPA) 0.0017 0.0025 0.0863
Onchocerca volvulus Cathepsin L homolog 0.0017 0.0025 0.1024
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0063 0.0617
Loa Loa (eye worm) hypothetical protein 0.0017 0.0026 0.0254
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0013 0.0008 0.0008
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0017 0.0026 0.0018
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0017 0.0025 0.0248
Onchocerca volvulus 0.0017 0.0025 0.1024
Brugia malayi hypothetical protein 0.0064 0.0246 0.2426
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0063 0.2365
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0111 0.0103
Leishmania major cathepsin L-like protease 0.0063 0.0239 1
Trypanosoma brucei ISWI complex protein 0.0015 0.0018 0.0552
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0026 0.0084
Loa Loa (eye worm) MH2 domain-containing protein 0.0117 0.0487 0.48
Schistosoma mansoni hypothetical protein 0.0047 0.0166 0.0538
Loa Loa (eye worm) ctsf protein 0.0017 0.0025 0.0248
Brugia malayi PHD-finger family protein 0.0024 0.0061 0.0603
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Loa Loa (eye worm) hypothetical protein 0.0017 0.0025 0.0248
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.1014 0.1007
Leishmania major hypothetical protein, conserved 0.0025 0.0063 0.2456
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0005 0.0049
Echinococcus granulosus zinc finger protein 0.0019 0.0037 0.0037
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0025 0.0017
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0017 0.0025 0.1139
Brugia malayi Pepsin A precursor 0.0014 0.0013 0.0132
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.0752 0.2433
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0029 0.0282
Leishmania major cathepsin L-like protease 0.0017 0.0025 0.0863
Plasmodium vivax vivapain-2 0.0017 0.0025 0.0569
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.0239 1
Echinococcus granulosus lamin dm0 0.0027 0.0072 0.0072
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0063 0.2365
Loa Loa (eye worm) hypothetical protein 0.0037 0.0122 0.1201
Brugia malayi Cytochrome P450 family protein 0.0012 0.0005 0.0049
Onchocerca volvulus 0.0017 0.0025 0.1024
Loa Loa (eye worm) hypothetical protein 0.008 0.0317 0.3125
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Loa Loa (eye worm) hypothetical protein 0.004 0.0132 0.1306
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0063 0.2365
Plasmodium falciparum plasmepsin VI 0.0059 0.0221 1
Leishmania major cathepsin L-like protease 0.0063 0.0239 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0008 0.0081
Entamoeba histolytica cysteine proteinase, putative 0.0017 0.0025 1
Schistosoma mansoni hypothetical protein 0.0165 0.0712 0.2305
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Echinococcus multilocularis musashi 0.0027 0.0072 0.0064
Trypanosoma cruzi ISWI complex protein 0.0015 0.0018 0.0552
Schistosoma mansoni intermediate filament proteins 0.0027 0.0072 0.0232
Mycobacterium ulcerans anthranilate phosphoribosyltransferase 0.0615 0.2786 0.2782
Loa Loa (eye worm) aspartyl protease 6 0.0014 0.0013 0.0132
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Trypanosoma cruzi cysteine peptidase, putative 0.0017 0.0025 0.0863
Loa Loa (eye worm) fibroinase 0.0017 0.0025 0.0248
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Schistosoma mansoni survival motor neuron protein 0.0047 0.0166 0.0538
Brugia malayi hypothetical protein 0.0025 0.0063 0.0617
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0025 0.0082
Schistosoma mansoni lamin 0.0027 0.0072 0.0232
Onchocerca volvulus 0.0017 0.0025 0.1024
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.0218 0.021
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0239 1
Loa Loa (eye worm) cysteine protease 0.0017 0.0025 0.0248
Plasmodium falciparum plasmepsin I 0.0059 0.0221 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0017 0.0025 0.1139
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Trypanosoma cruzi major cysteine proteinase, putative 0.0049 0.0177 0.7348
Leishmania major cathepsin L-like protease 0.0017 0.0025 0.0863
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0025 0.0017
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0063 0.2456
Brugia malayi intermediate filament protein 0.0027 0.0072 0.0707
Plasmodium vivax vivapain-2 0.0017 0.0025 0.0569
Plasmodium falciparum cysteine proteinase falcipain 3 0.0017 0.0025 0.0569
Schistosoma mansoni hypothetical protein 0.0067 0.0256 0.083
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0063 0.2456
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0239 1
Onchocerca volvulus Cathepsin F homolog 0.0017 0.0025 0.1024
Echinococcus granulosus geminin 0.0165 0.0712 0.0712
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0063 0.2456
Echinococcus granulosus jun protein 0.0082 0.0327 0.0327
Entamoeba histolytica cysteine protease, putative 0.0017 0.0025 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Onchocerca volvulus 0.0017 0.0025 0.1024
Leishmania major cathepsin L-like protease 0.0063 0.0239 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Plasmodium falciparum plasmepsin II 0.0059 0.0221 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0069 0.0685
Echinococcus multilocularis zinc finger protein 0.0019 0.0037 0.0029
Brugia malayi Bromodomain containing protein 0.0073 0.0287 0.2828
Onchocerca volvulus 0.0014 0.0013 0.0543
Plasmodium falciparum plasmepsin IV 0.0059 0.0221 1
Onchocerca volvulus 0.0047 0.0166 0.6757
Brugia malayi cytoplasmic intermediate filament protein 0.0014 0.0015 0.0145
Schistosoma mansoni memapsin-2 (A01 family) 0.0014 0.0013 0.0043
Schistosoma mansoni zinc finger protein 0.0019 0.0037 0.012
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0017 0.0025 0.0569
Loa Loa (eye worm) hypothetical protein 0.0014 0.0013 0.0132
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0072 0.0707
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.0214 0.8925
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Echinococcus granulosus cathepsin l cysteine peptidase 0.0017 0.0025 0.0025
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0051 0.0164
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Brugia malayi aspartic protease BmAsp-2, identical 0.0014 0.0013 0.0132
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0082 0.0327 0.0327
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0051 0.0051
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0017 0.0025 0.0569
Brugia malayi Bromodomain containing protein 0.0037 0.0121 0.1198
Schistosoma mansoni bromodomain containing protein 0.0062 0.0234 0.0758
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0017 0.0025 0.0248
Mycobacterium ulcerans thymidine phosphorylase 0.2178 1 1
Onchocerca volvulus 0.0064 0.0246 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0013 0.0132
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0059 0.0221 0.0221
Brugia malayi Muscleblind-like protein 0.0146 0.0622 0.6132
Onchocerca volvulus 0.0017 0.0025 0.1024
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0239 1
Echinococcus multilocularis muscleblind protein 0.0146 0.0622 0.0614
Schistosoma mansoni hypothetical protein 0.0015 0.0018 0.0058
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Plasmodium vivax plasmepsin IV, putative 0.0059 0.0221 1
Echinococcus granulosus muscleblind protein 0.0146 0.0622 0.0622
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0059 0.0221 0.0213
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Echinococcus granulosus cathepsin l1 0.0017 0.0025 0.0025
Loa Loa (eye worm) hypothetical protein 0.0146 0.0622 0.6132
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0026 0.0018
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0015 0.0145
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0059 0.0221 0.0716
Plasmodium vivax aspartyl proteinase, putative 0.0059 0.0221 1
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0059 0.0221 1
Leishmania major hypothetical protein, conserved 0.0015 0.0018 0.0552
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Echinococcus multilocularis cysteine protease 0.0017 0.0025 0.0017
Brugia malayi aspartic protease BmAsp-1, identical 0.0014 0.0013 0.0132
Echinococcus multilocularis microtubule associated protein 2 0.068 0.3089 0.3083
Echinococcus multilocularis cysteine protease 0.0017 0.0025 0.0017
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 0.0005 0.0049
Leishmania major cathepsin L-like protease 0.0017 0.0025 0.0863
Onchocerca volvulus 0.0017 0.0025 0.1024
Schistosoma mansoni zinc finger protein 0.0015 0.0018 0.0058
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0042 0.0413
Brugia malayi Papain family cysteine protease containing protein 0.0017 0.0025 0.0248
Onchocerca volvulus Cathepsin L homolog 0.0017 0.0025 0.1024
Brugia malayi Cathepsin L-like precursor 0.0017 0.0025 0.0248
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0014 0.0013 0.0043
Onchocerca volvulus 0.0014 0.0013 0.0543
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0026 0.0084
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0017 0.0026 0.0084
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Brugia malayi MH2 domain containing protein 0.0117 0.0487 0.48
Loa Loa (eye worm) hypothetical protein 0.0012 0.0006 0.0059
Onchocerca volvulus 0.0027 0.0072 0.2915
Echinococcus granulosus cathepsin L cysteine proteinase 0.0017 0.0025 0.0025
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Brugia malayi hypothetical protein 0.0014 0.0013 0.0132
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Entamoeba histolytica cysteine proteinase, putative 0.0017 0.0025 1
Brugia malayi bZIP transcription factor family protein 0.0082 0.0327 0.3227
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.1014 0.1014
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0014 0.0013 0.0132
Echinococcus granulosus histone lysine methyltransferase setb 0.0017 0.0026 0.0026
Brugia malayi Cytochrome P450 family protein 0.0012 0.0005 0.0049
Schistosoma mansoni hypothetical protein 0.0165 0.0712 0.2305
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0072 0.0707
Onchocerca volvulus 0.0017 0.0025 0.1024
Loa Loa (eye worm) hypothetical protein 0.0146 0.0622 0.6132
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0166 0.1639
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Loa Loa (eye worm) hypothetical protein 0.0059 0.0221 0.2182
Toxoplasma gondii cathepsin CPL 0.0017 0.0025 0.0569
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0026 0.0084
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0082 0.0327 0.0319
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0111 0.0111
Mycobacterium tuberculosis Probable thymidine phosphorylase DeoA (tdrpase) (pyrimidine phosphorylase) 0.2178 1 1
Onchocerca volvulus 0.0027 0.0072 0.2915
Echinococcus multilocularis muscleblind protein 1 0.0146 0.0622 0.0614
Loa Loa (eye worm) hypothetical protein 0.0069 0.0267 0.2638
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Schistosoma mansoni microtubule-associated protein tau 0.068 0.3089 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0239 1
Schistosoma mansoni jun-related protein 0.0067 0.0256 0.083
Loa Loa (eye worm) hypothetical protein 0.0027 0.0072 0.0707
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0017 0.0025 0.1139
Brugia malayi Eukaryotic aspartyl protease family protein 0.0014 0.0013 0.0132
Schistosoma mansoni lamin 0.0027 0.0072 0.0232
Toxoplasma gondii aspartyl protease ASP1 0.0059 0.0221 1
Schistosoma mansoni hypothetical protein 0.002 0.0042 0.0136
Leishmania major cathepsin L-like protease 0.0017 0.0025 0.0863
Loa Loa (eye worm) hypothetical protein 0.0012 0.0006 0.0059
Loa Loa (eye worm) hypothetical protein 0.0231 0.1014 1
Echinococcus granulosus intermediate filament protein 0.0027 0.0072 0.0072
Echinococcus multilocularis geminin 0.0165 0.0712 0.0704
Brugia malayi hypothetical protein 0.0014 0.0013 0.0132
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0025 0.0082
Mycobacterium leprae Probable anthranilate phosphoribosyltransferase TrpD 0.0615 0.2786 0.5
Echinococcus multilocularis thymidine phosphorylase 0.2178 1 1
Echinococcus granulosus microtubule associated protein 2 0.068 0.3089 0.3089
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0026 0.0026
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0059 0.0221 1
Trypanosoma cruzi ISWI complex protein 0.0015 0.0018 0.0552
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0017 0.0025 0.1139
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0051 0.0042
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0025 0.0017

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 1200 nM Compound was evaluated for inhibitory activity against human kidney renin ChEMBL. 3305947
Ki (binding) = 1200 nM Compound was evaluated for inhibitory activity against human kidney renin ChEMBL. 3305947

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

No external resources registered 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.