Detailed information for compound 1072849

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 328.28 | Formula: C15H12N4O5
  • H donors: 1 H acceptors: 5 LogP: 2.71 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc(cc1)[N+](=O)[O-])NN=C(c1cccc(c1)[N+](=O)[O-])C
  • InChi: 1S/C15H12N4O5/c1-10(12-3-2-4-14(9-12)19(23)24)16-17-15(20)11-5-7-13(8-6-11)18(21)22/h2-9H,1H3,(H,17,20)
  • InChiKey: GWLZVVUTFQVENI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0053 0.062 0.113
Leishmania major cathepsin L-like protease 0.0016 0.0073 0.0011
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0016 0.0073 0.0011
Plasmodium vivax hypothetical protein, conserved 0.0107 0.142 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0047 0.053 0.0966
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0108 0.1431 0.0576
Loa Loa (eye worm) hypothetical protein 0.0095 0.1237 0.2254
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0095 0.1237 1
Loa Loa (eye worm) beta-lactamase 0.0107 0.142 0.2587
Entamoeba histolytica Acid sphingomyelinase-like phosphodiesterase, putative 0.0095 0.1237 1
Brugia malayi glutathione reductase 0.0047 0.053 0.0966
Loa Loa (eye worm) thioredoxin reductase 0.0047 0.053 0.0966
Loa Loa (eye worm) hypothetical protein 0.0052 0.0605 0.1103
Mycobacterium tuberculosis Probable dehydrogenase 0.0108 0.1431 0.1369
Onchocerca volvulus 0.0016 0.0073 0.0511
Loa Loa (eye worm) cysteine protease 0.0016 0.0073 0.0132
Echinococcus multilocularis cysteine protease 0.0016 0.0073 0.0132
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0148 0.0574
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Schistosoma mansoni tar DNA-binding protein 0.0381 0.5488 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0047 0.053 0.0463
Onchocerca volvulus 0.0016 0.0073 0.0511
Echinococcus multilocularis cathepsin L cysteine protease 0.0016 0.0073 0.0132
Onchocerca volvulus 0.0107 0.142 1
Loa Loa (eye worm) Smad1 0.0016 0.0067 0.0122
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0148 0.1685
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.012 0.161 1
Brugia malayi Smad1 0.0016 0.0067 0.0122
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0108 0.1431 0.1369
Echinococcus granulosus tar DNA binding protein 0.0381 0.5488 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0022 0.0148 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0016 0.0073 0.0033
Mycobacterium ulcerans lipase LipD 0.0107 0.142 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0071 0.0129
Echinococcus multilocularis tumor protein p63 0.0367 0.5275 0.9613
Echinococcus granulosus beta LACTamase domain containing family member 0.0107 0.142 0.2587
Plasmodium vivax vivapain-2 0.0016 0.0073 0.0011
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0107 0.142 1
Schistosoma mansoni tar DNA-binding protein 0.0381 0.5488 1
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Loa Loa (eye worm) hypothetical protein 0.0026 0.021 0.0383
Echinococcus multilocularis cathepsin L cysteine protease 0.0016 0.0073 0.0132
Leishmania major cathepsin L-like protease 0.0063 0.0761 0.5117
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Schistosoma mansoni lamin 0.0053 0.062 0.113
Treponema pallidum exodeoxyribonuclease (exoA) 0.0022 0.0148 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0022 0.0148 0.0271
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0108 0.1431 0.1369
Plasmodium falciparum thioredoxin reductase 0.0047 0.053 1
Onchocerca volvulus 0.0053 0.062 0.4366
Echinococcus multilocularis lamin dm0 0.0053 0.062 0.113
Echinococcus multilocularis geminin 0.0195 0.2719 0.4955
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0067 0.0122
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0016 0.0073 0.0033
Loa Loa (eye worm) glutathione reductase 0.0047 0.053 0.0966
Loa Loa (eye worm) intermediate filament protein 0.0053 0.062 0.113
Echinococcus multilocularis Smad4 0.0016 0.0067 0.0122
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0067 0.0122
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0029 0.0252 0.0459
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Loa Loa (eye worm) RNA binding protein 0.0381 0.5488 1
Echinococcus granulosus mothers against decapentaplegic 5 0.0016 0.0067 0.0122
Plasmodium vivax vivapain-2 0.0016 0.0073 0.0011
Schistosoma mansoni intermediate filament proteins 0.0053 0.062 0.113
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Schistosoma mansoni hypothetical protein 0.0195 0.2719 0.4955
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0016 0.0073 0.0132
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0016 0.0073 0.0132
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0108 0.1431 0.1369
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Loa Loa (eye worm) ctsf protein 0.0016 0.0073 0.0132
Echinococcus granulosus lamin dm0 0.0053 0.062 0.113
Trypanosoma cruzi hypothetical protein, conserved 0.0107 0.142 1
Onchocerca volvulus 0.0016 0.0073 0.0511
Echinococcus granulosus cathepsin l cysteine peptidase 0.0016 0.0073 0.0132
Echinococcus granulosus lamin 0.0053 0.062 0.113
Loa Loa (eye worm) fibroinase 0.0016 0.0073 0.0132
Plasmodium vivax glutathione reductase, putative 0.0047 0.053 0.3405
Onchocerca volvulus 0.0107 0.142 1
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0022 0.0148 0.0574
Mycobacterium tuberculosis Probable oxidoreductase 0.012 0.161 0.155
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.142 1
Leishmania major cysteine peptidase A (CPA) 0.0016 0.0073 0.0011
Schistosoma mansoni smad 0.0016 0.0067 0.0122
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Schistosoma mansoni lamin 0.0053 0.062 0.113
Brugia malayi beta-lactamase 0.0107 0.142 0.2587
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0016 0.0073 0.0011
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0022 0.0148 0.0078
Brugia malayi MH1 domain containing protein 0.0016 0.0067 0.0122
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0107 0.142 0.1358
Leishmania major hypothetical protein, conserved 0.0107 0.142 1
Echinococcus multilocularis tar DNA binding protein 0.0381 0.5488 1
Onchocerca volvulus Cathepsin L homolog 0.0016 0.0073 0.0511
Mycobacterium tuberculosis Conserved protein 0.0107 0.142 0.1358
Echinococcus granulosus geminin 0.0195 0.2719 0.4955
Brugia malayi TAR-binding protein 0.0381 0.5488 1
Schistosoma mansoni cathepsin F (C01 family) 0.0016 0.0073 0.0132
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0022 0.0148 0.0652
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0107 0.142 0.2587
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0022 0.0148 0.0574
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0148 0.0271
Trypanosoma cruzi trypanothione reductase, putative 0.0047 0.053 0.3405
Echinococcus granulosus tumor protein p63 0.0367 0.5275 0.9613
Leishmania major cathepsin L-like protease 0.0063 0.0761 0.5117
Echinococcus multilocularis mothers against decapentaplegic 5 0.0016 0.0067 0.0122
Onchocerca volvulus 0.0016 0.0073 0.0511
Schistosoma mansoni cathepsin F (C01 family) 0.0016 0.0073 0.0132
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Onchocerca volvulus 0.0016 0.0073 0.0511
Trichomonas vaginalis penicillin-binding protein, putative 0.0107 0.142 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0195 0.0356
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0071 0.0129
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0022 0.0148 0.0574
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0016 0.0067 0.0122
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Brugia malayi beta-lactamase family protein 0.0107 0.142 0.2587
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0026 0.021 0.0383
Toxoplasma gondii ABC1 family protein 0.0107 0.142 1
Trypanosoma cruzi cysteine peptidase, putative 0.0016 0.0073 0.0011
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.0761 0.5117
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Onchocerca volvulus 0.0054 0.0625 0.4402
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0022 0.0148 0.0574
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Echinococcus granulosus smad 0.0016 0.0067 0.0122
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Mycobacterium tuberculosis Probable hydrolase 0.0107 0.142 0.1358
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0016 0.0073 0.0033
Loa Loa (eye worm) TAR-binding protein 0.0381 0.5488 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0047 0.053 0.0966
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0108 0.1431 0.1369
Trypanosoma cruzi hypothetical protein, conserved 0.0107 0.142 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Schistosoma mansoni smad1 5 8 and 0.0016 0.0067 0.0122
Schistosoma mansoni tar DNA-binding protein 0.0381 0.5488 1
Loa Loa (eye worm) transcription factor SMAD2 0.0236 0.3341 0.6088
Brugia malayi MH2 domain containing protein 0.0016 0.0067 0.0122
Mycobacterium tuberculosis Probable lipase LipD 0.0107 0.142 0.1358
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0381 0.5488 1
Schistosoma mansoni ap endonuclease 0.0022 0.0148 0.0271
Leishmania major cathepsin L-like protease 0.0016 0.0073 0.0011
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0107 0.142 0.1358
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0022 0.0148 0.0271
Trypanosoma brucei trypanothione reductase 0.0047 0.053 0.3405
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0107 0.142 0.2587
Brugia malayi MH2 domain containing protein 0.0236 0.3341 0.6088
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0016 0.0073 0.0132
Loa Loa (eye worm) hypothetical protein 0.0054 0.0625 0.1139
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0107 0.142 0.1358
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0022 0.0148 0.0574
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.012 0.161 0.155
Brugia malayi Papain family cysteine protease containing protein 0.0016 0.0073 0.0132
Brugia malayi Intermediate filament tail domain containing protein 0.0053 0.062 0.113
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0022 0.0148 0.0271
Leishmania major cathepsin L-like protease 0.0016 0.0073 0.0011
Trichomonas vaginalis esterase, putative 0.0107 0.142 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Echinococcus granulosus cathepsin L cysteine proteinase 0.0016 0.0073 0.0132
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0006 0.0012
Onchocerca volvulus Cathepsin L homolog 0.0016 0.0073 0.0511
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0016 0.0073 0.0132
Onchocerca volvulus 0.0016 0.0073 0.0511
Mycobacterium tuberculosis Probable reductase 0.0108 0.1431 0.1369
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0148 0.0574
Echinococcus multilocularis smad 0.0016 0.0067 0.0122
Mycobacterium tuberculosis Conserved protein 0.0107 0.142 0.1358
Brugia malayi MH1 domain containing protein 0.0016 0.0067 0.0122
Onchocerca volvulus 0.0053 0.062 0.4366
Onchocerca volvulus 0.0107 0.142 1
Echinococcus granulosus cathepsin l1 0.0016 0.0073 0.0132
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0053 0.062 0.113
Leishmania major trypanothione reductase 0.0047 0.053 0.3405
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0107 0.142 0.2587
Echinococcus granulosus TGF beta signal transducer SmadC 0.0016 0.0067 0.0122
Mycobacterium ulcerans beta-lactamase 0.0107 0.142 1
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0761 0.5117
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Echinococcus granulosus intermediate filament protein 0.0053 0.062 0.113
Schistosoma mansoni ap endonuclease 0.0022 0.0148 0.0271
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Toxoplasma gondii thioredoxin reductase 0.0047 0.053 0.3405
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Plasmodium vivax thioredoxin reductase, putative 0.0047 0.053 0.3405
Mycobacterium tuberculosis Probable lipase LipE 0.0107 0.142 0.1358
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0071 0.0129
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.012 0.161 0.155
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0148 0.0574
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0016 0.0073 0.0011
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Brugia malayi MH2 domain containing protein 0.0016 0.0067 0.0122
Brugia malayi intermediate filament protein 0.0053 0.062 0.113
Schistosoma mansoni hypothetical protein 0.0195 0.2719 0.4955
Echinococcus multilocularis musashi 0.0053 0.062 0.113
Toxoplasma gondii cathepsin CPL 0.0016 0.0073 0.0011
Schistosoma mansoni tar DNA-binding protein 0.0381 0.5488 1
Plasmodium falciparum glutathione reductase 0.0047 0.053 1
Mycobacterium ulcerans hypothetical protein 0.0107 0.142 1
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.142 1
Leishmania major cathepsin L-like protease 0.0016 0.0073 0.0011
Schistosoma mansoni tar DNA-binding protein 0.0381 0.5488 1
Trypanosoma brucei hypothetical protein, conserved 0.0107 0.142 1
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0761 0.5117
Schistosoma mansoni smad1 5 8 and 0.0016 0.0067 0.0122
Onchocerca volvulus 0.0016 0.0073 0.0511
Schistosoma mansoni smad1 5 8 and 0.0016 0.0067 0.0122
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0026 0.021 0.0383
Brugia malayi beta-lactamase family protein 0.0107 0.142 0.2587
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Loa Loa (eye worm) MH2 domain-containing protein 0.0236 0.3341 0.6088
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0016 0.0073 0.0011
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0107 0.142 0.2587
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0071 0.0129
Schistosoma mansoni cellular tumor antigen P53 0.0054 0.0625 0.1139
Trypanosoma cruzi major cysteine proteinase, putative 0.0049 0.0561 0.3635
Leishmania major cathepsin L-like protease 0.0016 0.0073 0.0011
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0057 0.068 0.4516
Brugia malayi cytoplasmic intermediate filament protein 0.0029 0.0252 0.0459
Echinococcus granulosus Smad4 0.0016 0.0067 0.0122
Echinococcus multilocularis lamin 0.0053 0.062 0.113
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0761 0.5117
Trichomonas vaginalis D-aminoacylase, putative 0.0107 0.142 1
Brugia malayi Thioredoxin reductase 0.0047 0.053 0.0966
Mycobacterium tuberculosis Conserved protein 0.0107 0.142 0.1358
Onchocerca volvulus Cathepsin F homolog 0.0016 0.0073 0.0511
Loa Loa (eye worm) hypothetical protein 0.0107 0.142 0.2587
Mycobacterium tuberculosis Probable esterase LipL 0.0107 0.142 0.1358
Brugia malayi Cathepsin L-like precursor 0.0016 0.0073 0.0132
Trichomonas vaginalis penicillin-binding protein, putative 0.0107 0.142 1
Leishmania major cathepsin L-like protease 0.0063 0.0761 0.5117
Mycobacterium ulcerans esterase/lipase LipP 0.0107 0.142 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0016 0.0067 0.0122
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0016 0.0071 0.5
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0006 0.0012
Brugia malayi RNA binding protein 0.0381 0.5488 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0107 0.142 0.2587
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0022 0.0148 1
Toxoplasma gondii exonuclease III APE 0.0022 0.0148 0.0574
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0761 0.5117
Brugia malayi RNA recognition motif domain containing protein 0.0381 0.5488 1
Schistosoma mansoni Smad4 0.0016 0.0067 0.0122
Echinococcus multilocularis cysteine protease 0.0016 0.0073 0.0132
Loa Loa (eye worm) hypothetical protein 0.0025 0.0195 0.0356
Loa Loa (eye worm) hypothetical protein 0.0016 0.0073 0.0132

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) NOVARTIS: Antimalarial liver stage activity measured as a greater than 50% reduction in Plasmodium yoelii schizont area in HepG2-A16-CD81 cells at 10uM compound concentration, determined by immuno-fluorescence. ChEMBL. 22096101
CC50 > 10 uM NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7) ChEMBL. 18579783
EC50 (functional) > 0.406 uM NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
EC50 (functional) > 1.406 uM NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay ChEMBL. 18579783

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 18579783

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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