Detailed information for compound 1191450

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 356.376 | Formula: C18H20N4O4
  • H donors: 1 H acceptors: 5 LogP: 1.45 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCNc1cc(=O)c2c(c1=O)c(C)nc1c2c(=O)n(C)c(=O)n1C
  • InChi: 1S/C18H20N4O4/c1-5-6-7-19-10-8-11(23)13-12(15(10)24)9(2)20-16-14(13)17(25)22(4)18(26)21(16)3/h8,19H,5-7H2,1-4H3
  • InChiKey: CCIDJKDIFJRMHU-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
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0524 0.071
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0303 0.0303
Echinococcus granulosus tumor protein p63 0.0326 0.6628 0.6628
Schistosoma mansoni hypothetical protein 0.0019 0.012 0.0118
Giardia lamblia Hypothetical protein 0.0177 0.3465 0.5863
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0524 0.0614
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.004 0.004
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Plasmodium vivax SET domain protein, putative 0.0029 0.0337 0.6133
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0022 0.018 0.0591
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0303 0.0273
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0072 0.1235 1
Brugia malayi Thioredoxin family protein 0.0177 0.3465 0.3445
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0022 0.018 0.1166
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0036 0.0473 0.0444
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0036 0.0473 0.0636
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0243 0.487 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0337 0.0337
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0022 0.018 0.1166
Trichomonas vaginalis esterase, putative 0.0038 0.0524 0.0614
Mycobacterium ulcerans lipase LipD 0.0038 0.0524 0.1047
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0524 0.1001
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0036 0.0473 0.0473
Echinococcus granulosus lamin dm0 0.0028 0.0303 0.0303
Schistosoma mansoni inositol monophosphatase 0.0072 0.1235 0.1755
Toxoplasma gondii kringle domain-containing protein 0.0017 0.0083 0.0182
Echinococcus multilocularis muscleblind protein 1 0.0145 0.2793 0.2793
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0473 0.3626
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0072 0.1235 0.1883
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0337 0.0337
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0064 0.1076 0.2145
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.014 0.268 0.5467
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0127 0.2397 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0303 0.0303
Mycobacterium ulcerans putative transglutaminase-like protein 0.0177 0.3465 1
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0524 0.1001
Trichomonas vaginalis inositol monophosphatase, putative 0.0072 0.1235 0.1883
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0524 0.1047
Schistosoma mansoni loxhd1 0.0019 0.012 0.0118
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Schistosoma mansoni polycystin 1-related 0.0019 0.012 0.0118
Brugia malayi intermediate filament protein 0.0028 0.0303 0.0273
Mycobacterium ulcerans beta-lactamase 0.0038 0.0524 0.1047
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.2313 0.2313
Schistosoma mansoni lipoxygenase 0.0019 0.012 0.0118
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.2397 0.6751
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0036 0.0473 0.0524
Loa Loa (eye worm) hypothetical protein 0.0027 0.0293 0.0293
Schistosoma mansoni aldehyde dehydrogenase 0.0127 0.2397 0.3463
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0473 0.3626
Entamoeba histolytica hypothetical protein 0.0035 0.0455 0.0491
Loa Loa (eye worm) beta-lactamase 0.0038 0.0524 0.0524
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0524 0.0614
Schistosoma mansoni ap endonuclease 0.0022 0.018 0.0205
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.004 0.004
Giardia lamblia Fructose-bisphosphate aldolase 0.0287 0.5783 1
Echinococcus granulosus tissue type plasminogen activator 0.0017 0.0083 0.0083
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0036 0.0473 0.0636
Loa Loa (eye worm) hypothetical protein 0.0486 1 1
Mycobacterium tuberculosis Conserved protein 0.0177 0.3465 0.7091
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0269 0.5413 0.5413
Schistosoma mansoni aldehyde dehydrogenase 0.0127 0.2397 0.3463
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.012 0.012
Echinococcus multilocularis ubiquitin specific protease 41 0.0036 0.0473 0.0473
Brugia malayi beta-lactamase family protein 0.0038 0.0524 0.0494
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.2397 0.6751
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0337 0.0436
Onchocerca volvulus 0.0028 0.0303 0.031
Mycobacterium tuberculosis Long conserved protein 0.0177 0.3465 0.7091
Echinococcus granulosus lamin 0.0028 0.0303 0.0303
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0524 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0022 0.018 0.018
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.018 0.2883
Onchocerca volvulus 0.0099 0.1814 0.2439
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0524 0.0494
Schistosoma mansoni rab6-interacting 0.0019 0.012 0.0118
Loa Loa (eye worm) inositol-1 0.0072 0.1235 0.1235
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0064 0.1076 0.1878
Brugia malayi Isocitrate dehydrogenase 0.0015 0.004 0.0009
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0524 0.0524
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0036 0.0473 0.0524
Brugia malayi Pre-SET motif family protein 0.0204 0.4037 0.4018
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0314 0.0314
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0524 0.1001
Echinococcus multilocularis Transglutaminase 0.0177 0.3465 0.3465
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0455 0.0455
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0017 0.0083 0.0887
Mycobacterium ulcerans aldehyde dehydrogenase 0.0127 0.2397 0.6751
Mycobacterium tuberculosis Hypothetical protein 0.0177 0.3465 0.7091
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0022 0.018 0.018
Loa Loa (eye worm) TK/ROR protein kinase 0.0017 0.0083 0.0083
Brugia malayi MH2 domain containing protein 0.0123 0.2313 0.2289
Onchocerca volvulus 0.0048 0.0729 0.0909
Brugia malayi beta-lactamase family protein 0.0038 0.0524 0.0494
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.004 0.004
Entamoeba histolytica hypothetical protein 0.0035 0.0455 0.0491
Loa Loa (eye worm) hypothetical protein 0.0036 0.0473 0.0473
Schistosoma mansoni intermediate filament proteins 0.0028 0.0303 0.0387
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0337 0.1258
Entamoeba histolytica hypothetical protein 0.0035 0.0455 0.0491
Giardia lamblia Transglutaminase/protease, putative 0.0177 0.3465 0.5863
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.012 0.012
Mycobacterium tuberculosis Conserved protein 0.0038 0.0524 0.1001
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0337 0.0337
Echinococcus multilocularis muscleblind protein 0.0145 0.2793 0.2793
Schistosoma mansoni hypothetical protein 0.0017 0.0083 0.0063
Brugia malayi hypothetical protein 0.0035 0.0455 0.0425
Onchocerca volvulus 0.0028 0.0303 0.031
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0287 0.5783 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0072 0.1235 0.5069
Trichomonas vaginalis set domain proteins, putative 0.0232 0.4634 0.7948
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0072 0.1235 1
Onchocerca volvulus 0.0038 0.0524 0.062
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.3633 0.5277
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0036 0.0473 0.0473
Mycobacterium ulcerans transglutaminase family protein 0.0177 0.3465 1
Onchocerca volvulus 0.0029 0.0337 0.0357
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0524 0.0524
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0455 0.0455
Onchocerca volvulus 0.0038 0.0524 0.062
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0524 0.1001
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0036 0.0473 0.0473
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Onchocerca volvulus 0.0038 0.0524 0.062
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0185 0.3633 0.3633
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0524 0.0614
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Brugia malayi isocitrate dehydrogenase 0.0015 0.004 0.0009
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.012 0.012
Trichomonas vaginalis conserved hypothetical protein 0.0036 0.0473 0.0524
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0524 0.1001
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0337 0.0436
Brugia malayi Doublecortin family protein 0.0019 0.012 0.0089
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0036 0.0473 0.0524
Leishmania major hypothetical protein, conserved 0.0017 0.0083 0.0182
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.4037 0.4037
Trypanosoma cruzi hypothetical protein, conserved 0.0017 0.0083 0.0359
Schistosoma mansoni hypothetical protein 0.0099 0.1814 0.2606
Echinococcus multilocularis inositol monophosphatase 1 0.0072 0.1235 0.1235
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0036 0.0473 0.0473
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0524 0.0614
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0036 0.0473 0.1838
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Schistosoma mansoni ap endonuclease 0.0022 0.018 0.0205
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0019 0.012 0.012
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0337 0.0436
Echinococcus multilocularis lamin dm0 0.0028 0.0303 0.0303
Echinococcus multilocularis tissue type plasminogen activator 0.0017 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0019 0.012 0.012
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0287 0.5783 1
Echinococcus granulosus ubiquitin specific protease 41 0.0036 0.0473 0.0473
Mycobacterium ulcerans hypothetical protein 0.0038 0.0524 0.1047
Brugia malayi hypothetical protein 0.0019 0.012 0.0089
Echinococcus multilocularis tumor protein p63 0.0326 0.6628 0.6628
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0053 0.0846 0.0846
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.012 0.012
Schistosoma mansoni lamin 0.0028 0.0303 0.0387
Plasmodium falciparum cysteine repeat modular protein 1 0.0017 0.0083 0.3075
Schistosoma mansoni hypothetical protein 0.0337 0.6847 1
Echinococcus multilocularis survival motor neuron protein 1 0.0486 1 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.004 0.004
Onchocerca volvulus 0.0353 0.7183 1
Brugia malayi Muscleblind-like protein 0.0145 0.2793 0.2771
Echinococcus granulosus survival motor neuron protein 1 0.0486 1 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0185 0.3633 0.3633
Brugia malayi follicle stimulating hormone receptor 0.0269 0.5413 0.5398
Mycobacterium leprae Conserved hypothetical protein 0.0177 0.3465 1
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0036 0.0473 0.3626
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0185 0.3633 0.3613
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.012 0.012
Echinococcus multilocularis geminin 0.0337 0.6847 0.6847
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.3633 0.5277
Mycobacterium ulcerans hypothetical protein 0.0177 0.3465 1
Echinococcus granulosus inositol monophosphatase 1 0.0072 0.1235 0.1235
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0072 0.1235 1
Brugia malayi Pre-SET motif family protein 0.0029 0.0337 0.0306
Entamoeba histolytica hypothetical protein 0.0035 0.0455 0.0491
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0185 0.3633 0.3633
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.018 0.0149
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.3633 0.5277
Loa Loa (eye worm) hypothetical protein 0.0017 0.0083 0.0083
Schistosoma mansoni lipoxygenase 0.0053 0.0846 0.1184
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.012 0.1658
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0022 0.018 0.018
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.014 0.268 0.7612
Loa Loa (eye worm) hypothetical protein 0.0145 0.2793 0.2793
Loa Loa (eye worm) hypothetical protein 0.0145 0.2793 0.2793
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Loa Loa (eye worm) doublecortin family protein 0.0019 0.012 0.012
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0524 0.0524
Echinococcus granulosus RUN 0.0019 0.012 0.012
Schistosoma mansoni hypothetical protein 0.0337 0.6847 1
Mycobacterium leprae Conserved hypothetical protein 0.0177 0.3465 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0127 0.2397 0.2397
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Schistosoma mansoni hypothetical protein 0.0177 0.3465 0.5031
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0022 0.018 0.1166
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0524 0.071
Echinococcus granulosus muscleblind protein 0.0145 0.2793 0.2793
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0031 0.0031
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0036 0.0473 0.0524
Mycobacterium tuberculosis Conserved hypothetical protein 0.0177 0.3465 0.7091
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0022 0.018 0.0289
Toxoplasma gondii ABC1 family protein 0.0038 0.0524 0.2051
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.014 0.268 0.7333
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0099 0.1814 0.1789
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0053 0.0846 0.0846
Brugia malayi Inositol-1 0.0072 0.1235 0.1208
Brugia malayi beta-lactamase 0.0038 0.0524 0.0494
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.004 0.004
Mycobacterium ulcerans hypothetical protein 0.0177 0.3465 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0177 0.3465 0.7091
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0127 0.2397 0.4881
Onchocerca volvulus 0.0019 0.012 0.0052
Schistosoma mansoni rab6-interacting 0.0019 0.012 0.0118
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0185 0.3633 0.3633
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.004 0.004
Mycobacterium tuberculosis Conserved protein 0.0038 0.0524 0.1001
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0729 0.1011
Onchocerca volvulus 0.0019 0.012 0.0052
Trichomonas vaginalis peptide N-glycanase, putative 0.0177 0.3465 0.5863
Schistosoma mansoni hypothetical protein 0.0035 0.0455 0.0609
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.018 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0287 0.5783 1
Echinococcus multilocularis lamin 0.0028 0.0303 0.0303
Schistosoma mansoni lamin 0.0028 0.0303 0.0387
Echinococcus granulosus geminin 0.0337 0.6847 0.6847
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0337 0.0436
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0524 0.4046
Treponema pallidum fructose-bisphosphate aldolase 0.0287 0.5783 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0524 0.4046
Brugia malayi Kringle domain containing protein 0.0017 0.0083 0.0052
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0524 0.1001
Loa Loa (eye worm) hypothetical protein 0.0029 0.0337 0.0337
Toxoplasma gondii aldehyde dehydrogenase 0.0127 0.2397 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0524 0.1047
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0185 0.3633 0.3633
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0072 0.1235 0.3213
Leishmania major hypothetical protein, conserved 0.0038 0.0524 0.2051
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0127 0.2397 0.2397
Brugia malayi Protein kinase domain containing protein 0.0017 0.0083 0.0052
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.012 0.5749
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0455 0.0609
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0524 0.4046
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0303 0.0303
Schistosoma mansoni survival motor neuron protein 0.0099 0.1814 0.2606
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0072 0.1235 0.1883
Brugia malayi hypothetical protein 0.0019 0.012 0.0089
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0072 0.1235 1
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0524 0.0614
Echinococcus granulosus intermediate filament protein 0.0028 0.0303 0.0303
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0072 0.1235 0.5069
Echinococcus multilocularis RUN 0.0019 0.012 0.012
Schistosoma mansoni inositol monophosphatase 0.0072 0.1235 0.1755
Toxoplasma gondii exonuclease III APE 0.0022 0.018 0.0591
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0072 0.1235 0.1883
Echinococcus granulosus Transglutaminase 0.0177 0.3465 0.3465
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.2313 0.2313
Onchocerca volvulus 0.0232 0.4634 0.6409
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0524 0.1001
Mycobacterium tuberculosis Conserved protein 0.0038 0.0524 0.1001
Loa Loa (eye worm) hypothetical protein 0.0048 0.0729 0.0729
Loa Loa (eye worm) hypothetical protein 0.0038 0.0524 0.0524
Echinococcus multilocularis musashi 0.0028 0.0303 0.0303

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 5.2 uM Cytotoxicity against human AGS cells after 72 hrs by MTT assay ChEMBL. 20828890
IC50 (functional) = 15.2 uM Cytotoxicity against human SKMES1 cells after 72 hrs by MTT assay ChEMBL. 20828890
IC50 (functional) = 17.9 uM Cytotoxicity against human J82 cells after 72 hrs by MTT assay ChEMBL. 20828890
IC50 (functional) = 19.7 uM Cytotoxicity against human HL-60(TB) cells after 72 hrs by MTT assay ChEMBL. 20828890
IC50 (ADMET) = 19.9 uM Cytotoxicity against human MRC5 cells after 72 hrs by MTT assay ChEMBL. 20828890

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 20828890

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

No literature references available for this target.

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