Detailed information for compound 1799635

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 308.801 | Formula: C20H17ClO
  • H donors: 1 H acceptors: 1 LogP: 6.26 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=CCC(c1c(O)ccc2c1cccc2)c1ccc(cc1)Cl
  • InChi: 1S/C20H17ClO/c1-2-5-17(15-8-11-16(21)12-9-15)20-18-7-4-3-6-14(18)10-13-19(20)22/h2-4,6-13,17,22H,1,5H2
  • InChiKey: KBVAZCNQJHDMMI-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
Echinococcus multilocularis cpg binding protein 0.0028 0.0242 0.0242
Brugia malayi NADPH:adrenodoxin oxidoreductase, mitochondrial precursor 0.0023 0.0183 0.0553
Mycobacterium ulcerans hypothetical protein 0.016 0.1709 1
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0085 0.0879 0.1724
Trypanosoma cruzi trypanothione reductase, putative 0.0246 0.2667 0.8067
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0562 0.6173 0.8958
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0011 0.0011
Echinococcus granulosus neuropeptide s receptor 0.0466 0.51 1
Brugia malayi Associated with TFs and helicases family protein 0.0011 0.0055 0.0166
Plasmodium vivax NAD(P)H-dependent glutamate synthase, putative 0.0023 0.0183 0.0489
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0562 0.6173 0.8958
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0388 0.1273
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0151 0.0456
Trichomonas vaginalis glutathione reductase, putative 0.0085 0.0879 0.2889
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0085 0.0879 0.1014
Echinococcus multilocularis Chromobox protein 3 0.0011 0.0055 0.0055
Schistosoma mansoni hypothetical protein 0.0011 0.0055 0.0063
Echinococcus multilocularis thioredoxin glutathione reductase 0.0248 0.2683 0.2683
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0304 0.3307 1
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0085 0.0879 0.3225
Entamoeba histolytica hypothetical protein 0.0067 0.0677 0.2226
Brugia malayi glutamate synthase 0.0023 0.0183 0.0553
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0204 0.2199 0.6662
Loa Loa (eye worm) TKL/MLK/LZK protein kinase 0.0303 0.3301 1
Toxoplasma gondii hypothetical protein 0.0049 0.0475 0.1695
Schistosoma mansoni zinc finger protein 0.0015 0.0094 0.0108
Brugia malayi MH1 domain containing protein 0.0008 0.0025 0.0075
Schistosoma mansoni cpg binding protein 0.0028 0.0242 0.0279
Echinococcus multilocularis chromobox protein 2 0.0011 0.0055 0.0055
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0023 0.0183 0.0276
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0055 0.018
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0261 0.0261
Loa Loa (eye worm) hypothetical protein 0.0037 0.0339 0.1028
Schistosoma mansoni methyl-cpg binding protein mbd 0.0016 0.0112 0.013
Schistosoma mansoni Smad4 0.0008 0.0025 0.0029
Brugia malayi Pre-SET motif family protein 0.003 0.0261 0.0792
Leishmania major hypothetical protein, conserved 0.0023 0.0183 0.0276
Giardia lamblia Fructose-bisphosphate aldolase 0.028 0.3043 1
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0509 0.154
Brugia malayi hypothetical protein 0.0067 0.0677 0.2052
Schistosoma mansoni chromobox protein 0.0068 0.0688 0.0793
Brugia malayi Heterochromatin protein 1 0.0068 0.0688 0.2085
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0067 0.0677 0.0677
Trypanosoma cruzi ISWI complex protein 0.0015 0.0094 0.0283
Brugia malayi Bromodomain containing protein 0.0037 0.0339 0.1026
Trypanosoma brucei hypothetical protein, conserved 0.0023 0.0183 0.0276
Trypanosoma cruzi ISWI complex protein 0.0015 0.0094 0.0283
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0261 0.0301
Plasmodium falciparum glutathione reductase 0.0246 0.2667 1
Brugia malayi Thioredoxin reductase 0.0246 0.2667 0.8082
Echinococcus granulosus chromobox protein 2 0.0011 0.0055 0.0107
Schistosoma mansoni kinase 0.0131 0.1386 0.1598
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0011 0.0055 0.0063
Leishmania major mitochondrial DNA polymerase beta 0.0304 0.3307 1
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Schistosoma mansoni hypothetical protein 0.0023 0.0183 0.021
Brugia malayi Protein kinase domain containing protein 0.0303 0.3301 1
Plasmodium falciparum type II NADH:ubiquinone oxidoreductase 0.0023 0.0183 0.0489
Echinococcus granulosus histone lysine methyltransferase setb 0.0046 0.0443 0.0868
Schistosoma mansoni hypothetical protein 0.0353 0.3845 0.4433
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0023 0.0183 0.0586
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0443 0.0511
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0011 0.0055 0.0107
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0029
Echinococcus multilocularis smad 0.0008 0.0025 0.0025
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.0939 0.2846
Trypanosoma cruzi polo-like protein kinase, putative 0.0258 0.2795 0.8451
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0028 0.0028
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0028 0.0028
Brugia malayi Protein cec-1. 0.0011 0.0055 0.0166
Echinococcus granulosus zinc finger protein 0.002 0.0155 0.0304
Brugia malayi MH1 domain containing protein 0.0008 0.0025 0.0075
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0406 0.1226
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2445
Trichomonas vaginalis glutamate synthase, putative 0.0023 0.0183 0.06
Schistosoma mansoni serine/threonine protein kinase 0.0308 0.3346 0.3857
Trypanosoma brucei 2,4-dienoyl-coa reductase-like protein 0.0023 0.0183 0.0276
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0406 0.1226
Echinococcus granulosus sulfide:quinone oxidoreductase 0.0023 0.0183 0.0358
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0243 0.0477
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0085 0.0879 0.2445
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0137 0.1451 0.1897
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0023 0.0183 0.0358
Trypanosoma cruzi NADH dehydrogenase, putative 0.0023 0.0183 0.0552
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0059 0.0584 0.0674
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0011 0.0055 0.0063
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0406 0.1226
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0023 0.0183 0.06
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0014 0.0091 0.0091
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0088 0.0911 0.105
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0025 0.0075
Loa Loa (eye worm) hypothetical protein 0.0038 0.0355 0.1076
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0085 0.0879 1
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0137 0.1451 0.1897
Schistosoma mansoni dishevelled 0.0009 0.0028 0.0032
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0939 0.1083
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0187 0.0366
Trypanosoma cruzi trypanothione reductase, putative 0.0085 0.0879 0.2659
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0011 0.0055 0.0102
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0028 0.0032
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0088 0.0911 0.105
Loa Loa (eye worm) hypothetical protein 0.0042 0.0401 0.1214
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0014 0.0088 0.029
Schistosoma mansoni hypothetical protein 0.0067 0.0677 0.0781
Onchocerca volvulus 0.0011 0.0055 0.0196
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.0582 0.1142
Echinococcus multilocularis neuropeptide s receptor 0.0466 0.51 0.51
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0055 0.018
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0088 0.0911 0.1786
Toxoplasma gondii histone lysine methyltransferase SET1 0.005 0.0489 0.1746
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0025 0.0049
Loa Loa (eye worm) hypothetical protein 0.003 0.0264 0.0799
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.3307 1
Echinococcus granulosus NADPH:adrenodoxin oxidoreductase 0.0023 0.0183 0.0358
Schistosoma mansoni hypothetical protein 0.0292 0.3174 0.3659
Plasmodium vivax glutathione reductase, putative 0.0246 0.2667 1
Echinococcus granulosus neuropeptide receptor A26 0.0466 0.51 1
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Brugia malayi N-terminal motif family protein 0.0178 0.1902 0.5763
Schistosoma mansoni chromobox protein 0.0068 0.0688 0.0793
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0009 0.0028 0.01
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0085 0.0879 0.2664
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0443 0.0511
Echinococcus multilocularis geminin 0.0292 0.3174 0.3174
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0119 0.036
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0025 0.0049
Mycobacterium tuberculosis Probable reductase 0.0562 0.6173 0.8958
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Entamoeba histolytica thioredoxin reductase, putative 0.0023 0.0183 0.06
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0388 0.1273
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0023 0.0183 0.0552
Plasmodium vivax type II NADH:ubiquinone oxidoreductase, putative 0.0023 0.0183 0.0489
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0028 0.0028
Echinococcus multilocularis Smad4 0.0008 0.0025 0.0025
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0028 0.0028
Echinococcus multilocularis zinc finger protein 0.002 0.0155 0.0155
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Leishmania major hypothetical protein, conserved 0.0023 0.0183 0.0276
Leishmania major hypothetical protein, conserved 0.0023 0.0183 0.0276
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0231 0.076
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0011 0.0013
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Schistosoma mansoni methyl-cpg binding protein mbd 0.0016 0.0112 0.013
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0187 0.0215
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0025 0.0075
Leishmania major NADH dehydrogenase, putative 0.0023 0.0183 0.0276
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0085 0.0879 0.2445
Schistosoma mansoni dep domain containing protein 0.0009 0.0028 0.0032
Toxoplasma gondii Alpha-galactosidase 0.0012 0.007 0.0158
Echinococcus granulosus Chromobox protein 3 0.0011 0.0055 0.0107
Echinococcus granulosus thioredoxin glutathione reductase 0.0248 0.2683 0.5261
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0028 0.0055
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0562 0.6173 0.8958
Brugia malayi Smad1 0.0008 0.0025 0.0075
Entamoeba histolytica pyridine nucleotide-disulfide oxidoreductase family protein 0.0023 0.0183 0.06
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0023 0.0183 0.06
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0688 0.2261
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0939 0.0939
Plasmodium falciparum thioredoxin reductase 0.0085 0.0879 0.3155
Mycobacterium ulcerans aldehyde dehydrogenase 0.0052 0.0512 0.2158
Loa Loa (eye worm) helicase 0.0011 0.0055 0.0166
Trypanosoma brucei NADH dehydrogenase 0.0023 0.0183 0.0276
Echinococcus multilocularis neuropeptide receptor A26 0.0466 0.51 0.51
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0088 0.0911 0.0911
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1529 0.4466
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0025 0.0029
Loa Loa (eye worm) heterochromatin protein 1 0.0068 0.0688 0.2085
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0085 0.0879 0.2659
Schistosoma mansoni disulfide oxidoreductase 0.0023 0.0183 0.021
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0939 0.1842
Echinococcus multilocularis glutamate synthase 0.0023 0.0183 0.0183
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0011 0.0055 0.0055
Leishmania major 2,4-dienoyl-coa reductase-like protein 0.0023 0.0183 0.0276
Plasmodium vivax thioredoxin reductase, putative 0.0246 0.2667 1
Leishmania major trypanothione reductase 0.0246 0.2667 0.801
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0144 0.1529 0.4466
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Trichomonas vaginalis chromobox protein, putative 0.0011 0.0055 0.018
Mycobacterium tuberculosis Conserved hypothetical protein 0.016 0.1709 0.2283
Echinococcus granulosus methyl CpG binding domain protein 2 0.0016 0.0112 0.022
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0028 0.0055
Mycobacterium tuberculosis Probable oxidoreductase 0.0625 0.687 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0088 0.0911 0.105
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0029
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0047 0.0143
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.0303 0.3301 0.6472
Schistosoma mansoni smad 0.0008 0.0025 0.0029
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0028 0.0028
Trichomonas vaginalis glutamate synthase, putative 0.0023 0.0183 0.06
Echinococcus multilocularis sulfide:quinone oxidoreductase 0.0023 0.0183 0.0183
Schistosoma mansoni hypothetical protein 0.002 0.0151 0.0174
Onchocerca volvulus 0.0025 0.0206 0.0736
Loa Loa (eye worm) hypothetical protein 0.0178 0.1902 0.5763
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0011 0.0055 0.0166
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0011 0.0011
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0023 0.0183 0.0553
Schistosoma mansoni aldehyde dehydrogenase 0.0052 0.0512 0.059
Trypanosoma cruzi polo-like protein kinase, putative 0.0258 0.2795 0.8451
Schistosoma mansoni hypothetical protein 0.0292 0.3174 0.3659
Mycobacterium ulcerans aldehyde dehydrogenase 0.0052 0.0512 0.2158
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0085 0.0879 0.3155
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0052 0.0512 0.0512
Onchocerca volvulus 0.003 0.0264 0.0943
Echinococcus multilocularis apoptosis inducing factor 1 mitochondrial 0.0023 0.0183 0.0183
Onchocerca volvulus 0.0009 0.0028 0.01
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0562 0.6173 0.8958
Loa Loa (eye worm) hypothetical protein 0.0046 0.0443 0.1342
Entamoeba histolytica serine/threonine protein kinase, putative 0.0258 0.2795 0.9184
Trypanosoma brucei pyridine nucleotide-disulphide oxidoreductase, putative 0.0023 0.0183 0.0276
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0085 0.0879 1
Schistosoma mansoni serine/threonine protein kinase 0.0258 0.2795 0.3222
Plasmodium falciparum thioredoxin reductase 0.0246 0.2667 1
Trichomonas vaginalis conserved hypothetical protein 0.0014 0.0088 0.029
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0052 0.0512 0.1302
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0258 0.2795 0.8467
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0088 0.0911 0.0911
Entamoeba histolytica hypothetical protein 0.0067 0.0677 0.2226
Brugia malayi DIX domain containing protein 0.0009 0.0028 0.0084
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0939 0.0939
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0046 0.0443 0.0443
Brugia malayi MH2 domain containing protein 0.0008 0.0025 0.0075
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.3307 1
Brugia malayi MH2 domain containing protein 0.0008 0.0025 0.0075
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0562 0.6173 0.8958
Loa Loa (eye worm) hypothetical protein 0.0303 0.3291 0.9972
Loa Loa (eye worm) hypothetical protein 0.0009 0.0028 0.0084
Plasmodium vivax SET domain protein, putative 0.003 0.0261 0.079
Trypanosoma cruzi 2,4-dienoyl-coa reductase-like protein, putative 0.0023 0.0183 0.0552
Echinococcus multilocularis pyridine nucleotide disulfide oxidoreductase 0.0023 0.0183 0.0183
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0303 0.3301 0.3301
Trichomonas vaginalis CAMK family protein kinase 0.0128 0.1348 0.4432
Trypanosoma cruzi hypothetical protein, conserved 0.0023 0.0183 0.0552
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0059 0.0584 0.0674
Onchocerca volvulus 0.0232 0.2511 0.8986
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0034 0.0313 0.0615
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0085 0.0879 0.0879
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0014 0.0084 0.0275
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0055 0.018
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Schistosoma mansoni zinc finger protein 0.002 0.0155 0.0179
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0059 0.0584 0.1921
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0939 0.1083
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0041 0.0385 0.0444
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0028 0.0084
Brugia malayi Melibiase family protein 0.0059 0.0584 0.1771
Toxoplasma gondii chromodomain helicase DNA binding protein CHD1/SWI2/SNF2 0.0011 0.0055 0.0102
Trichomonas vaginalis mercuric reductase, putative 0.0085 0.0879 0.2889
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Echinococcus granulosus glutamate synthase 0.0023 0.0183 0.0358
Brugia malayi Valyl-tRNA synthetase 0.0011 0.0055 0.0166
Onchocerca volvulus 0.0023 0.0183 0.0653
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0023 0.0183 0.06
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0023 0.0183 0.06
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0025 0.0025
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0067 0.0677 0.1328
Echinococcus granulosus Chromo domain 0.0011 0.0055 0.0107
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0085 0.0879 0.4564
Brugia malayi glutathione reductase 0.0246 0.2667 0.8082
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0028 0.0084
Loa Loa (eye worm) hypothetical protein 0.0059 0.0584 0.1771
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0187 0.0187
Schistosoma mansoni cpg binding protein 0.0028 0.0242 0.0279
Treponema pallidum fructose-bisphosphate aldolase 0.028 0.3043 1
Brugia malayi SET domain containing protein 0.0013 0.0073 0.022
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0406 0.097
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0012 0.007 0.008
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0055 0.018
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Trypanosoma cruzi NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0023 0.0183 0.0552
Schistosoma mansoni transcription factor LCR-F1 0.0067 0.0677 0.0781
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0011 0.0055 0.018
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0688 0.2261
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Echinococcus granulosus pyridine nucleotide disulfide oxidoreductase 0.0023 0.0183 0.0358
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2445
Onchocerca volvulus Serine\/threonine kinase homolog 0.0258 0.2795 1
Echinococcus granulosus dnaJ subfamily B 0.0353 0.3845 0.754
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0085 0.0879 0.2445
Loa Loa (eye worm) CHromoDomain protein family member 0.0014 0.0091 0.0275
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Toxoplasma gondii aldehyde dehydrogenase 0.0052 0.0512 0.1834
Schistosoma mansoni hypothetical protein 0.0015 0.0094 0.0108
Loa Loa (eye worm) hypothetical protein 0.0303 0.3291 0.9972
Trypanosoma cruzi 2,4-dienoyl-coa reductase fadh1, putative 0.0023 0.0183 0.0552
Loa Loa (eye worm) hypothetical protein 0.0039 0.0365 0.1105
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0258 0.2795 0.8406
Entamoeba histolytica glutamate synthase beta subunit, putative 0.0023 0.0183 0.06
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Brugia malayi hypothetical protein 0.0011 0.0055 0.0166
Entamoeba histolytica hypothetical protein 0.0011 0.0055 0.018
Giardia lamblia Kinase, PLK 0.0258 0.2795 0.9132
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0011 0.0055 0.018
Toxoplasma gondii melibiase subfamily protein 0.0088 0.0911 0.3346
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0028 0.0032
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0137 0.1451 0.831
Trypanosoma brucei NADPH:adrenodoxin oxidoreductase, mitochondrial, putative 0.0023 0.0183 0.0276
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0085 0.0879 0.3155
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.1529 0.4622
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0011 0.0055 0.0063
Brugia malayi MH2 domain containing protein 0.0124 0.1311 0.3973
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0085 0.0879 0.1042
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0052 0.0512 0.1004
Entamoeba histolytica hypothetical protein 0.0067 0.0677 0.2226
Brugia malayi Pre-SET motif family protein 0.0204 0.2199 0.6662
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0023 0.0183 0.0586
Plasmodium falciparum NAD(P)H-dependent glutamate synthase, putative 0.0023 0.0183 0.0489
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0023 0.0183 0.0183
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Echinococcus granulosus apoptosis inducing factor 1 mitochondrial 0.0023 0.0183 0.0358
Echinococcus multilocularis dnaJ subfamily B 0.0353 0.3845 0.3845
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.028 0.3043 1
Loa Loa (eye worm) thioredoxin reductase 0.0246 0.2667 0.8082
Entamoeba histolytica hypothetical protein 0.0011 0.0055 0.018
Echinococcus granulosus cpg binding protein 0.0028 0.0242 0.0474
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0355 0.1271
Trichomonas vaginalis chromobox protein, putative 0.0011 0.0055 0.018
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0258 0.2795 0.2795
Toxoplasma gondii pyridine nucleotide-disulfide oxidoreductase domain-containing protein 0.0023 0.0183 0.0586
Leishmania major 2,4-dienoyl-coa reductase fadh1, putative 0.0023 0.0183 0.0276
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0016 0.0112 0.0112
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0011 0.0022
Schistosoma mansoni glutamate synthase 0.0023 0.0183 0.021
Plasmodium falciparum glutathione reductase 0.0085 0.0879 0.3155
Plasmodium vivax ferrodoxin reductase, putative 0.0023 0.0183 0.0489
Trypanosoma brucei polo-like protein kinase 0.0258 0.2795 0.8406
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0261 0.0884
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0085 0.0879 0.4564
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0178 0.1902 0.6807
Entamoeba histolytica NAD(FAD)-dependent dehydrogenase, putative 0.0023 0.0183 0.06
Echinococcus granulosus geminin 0.0292 0.3174 0.6224
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Toxoplasma gondii NADPH-glutathione reductase 0.0085 0.0879 0.3225
Brugia malayi serine/threonine-protein kinase plk-2 0.0258 0.2795 0.8467
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.1311 0.3973
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0054 0.0526 0.0606
Treponema pallidum NADH oxidase 0.0085 0.0879 0.2435
Schistosoma mansoni aldehyde dehydrogenase 0.0052 0.0512 0.059
Schistosoma mansoni dishevelled 0.0009 0.0028 0.0032
Toxoplasma gondii non-proton pumping type-II NADH dehydrogenase I 0.0023 0.0183 0.0586
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0023 0.0183 0.0183
Schistosoma mansoni chromobox protein 0.0011 0.0055 0.0063
Loa Loa (eye worm) pyridine nucleotide-disufhide oxidoreductase 0.0023 0.0183 0.0553
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0028 0.0055
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0028 0.0055
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0085 0.0879 0.2659
Loa Loa (eye worm) Smad1 0.0008 0.0025 0.0075
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0085 0.0879 0.2445
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Trichomonas vaginalis CAMK family protein kinase 0.0128 0.1348 0.4432
Brugia malayi PHD-finger family protein 0.0025 0.0212 0.0642
Loa Loa (eye worm) CXXC zinc finger family protein 0.0025 0.0206 0.0623
Schistosoma mansoni glutamate synthase 0.0023 0.0183 0.021
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0014 0.0091 0.0178
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0052 0.0512 0.0493
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0029
Entamoeba histolytica hypothetical protein 0.0067 0.0677 0.2226
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0388 0.1387
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0028 0.0084
Echinococcus multilocularis chromobox protein 1 0.0068 0.0688 0.0688
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0085 0.0879 0.2445
Schistosoma mansoni sulfide quinone reductase 0.0023 0.0183 0.021
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0028 0.0028
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0023 0.0183 0.0358
Loa Loa (eye worm) programmed cell death 8 0.0023 0.0183 0.0553
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0025 0.0025
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0183 0.0553
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0939 0.1083
Entamoeba histolytica disulphide oxidoreductase, putative 0.0023 0.0183 0.06
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0017 0.0117 0.0385
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0028 0.0055
Echinococcus multilocularis chromobox protein 1 0.0068 0.0688 0.0688
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0939 0.1842
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0258 0.2795 0.548
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0034 0.0313 0.0313
Brugia malayi M-phase phosphoprotein, mpp8 0.0011 0.0055 0.0166
Echinococcus granulosus chromobox protein 1 0.0068 0.0688 0.1349
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0625 0.687 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0625 0.687 1
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0014 0.0091 0.0105
Echinococcus multilocularis Chromo domain 0.0011 0.0055 0.0055
Trichomonas vaginalis dihydrolipoamide dehydrogenase, putative 0.0023 0.0183 0.06
Echinococcus granulosus smad 0.0008 0.0025 0.0049
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0017 0.0117 0.0385
Loa Loa (eye worm) hypothetical protein 0.0009 0.0028 0.0084
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0355 0.1168
Trichomonas vaginalis Heterochromatin protein, putative 0.0011 0.0055 0.018
Loa Loa (eye worm) DIX domain-containing protein 0.0009 0.0028 0.0084
Trypanosoma brucei trypanothione reductase 0.0246 0.2667 0.801
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0085 0.0879 0.4564
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.0939 0.2846
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0063 0.0627 0.1901
Brugia malayi CHD4 protein 0.0014 0.0091 0.0275
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Mycobacterium ulcerans aldehyde dehydrogenase 0.0052 0.0512 0.2158
Schistosoma mansoni chromobox protein 0.0011 0.0055 0.0063
Toxoplasma gondii NADH dehydrogenase (NDH2-II) 0.0023 0.0183 0.0586
Echinococcus granulosus chromobox protein 1 0.0068 0.0688 0.1349
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0085 0.0879 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.028 0.3043 1
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0028 0.0055
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0063 0.0627 0.1901
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0085 0.0879 0.2445
Loa Loa (eye worm) glutathione reductase 0.0246 0.2667 0.8082
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0355 0.1168
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Onchocerca volvulus 0.0011 0.0055 0.0196
Toxoplasma gondii selenide, water dikinase 0.0023 0.0183 0.0586
Brugia malayi regulator of G-protein signaling egl-10 0.0009 0.0028 0.0084
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Brugia malayi hypothetical protein 0.0009 0.0028 0.0084
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0011 0.0055 0.0102
Trichomonas vaginalis hypothetical protein 0.0011 0.0055 0.018
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0246 0.2667 0.3716
Brugia malayi hypothetical protein 0.0009 0.0028 0.0084
Trypanosoma cruzi hypothetical protein, conserved 0.0023 0.0183 0.0552
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.1311 0.3973
Schistosoma mansoni cpg binding protein 0.0025 0.0206 0.0237
Onchocerca volvulus 0.0041 0.0385 0.1378
Trichomonas vaginalis CAMK family protein kinase 0.0258 0.2795 0.9184
Trichomonas vaginalis chromobox protein, putative 0.0011 0.0055 0.018
Trypanosoma cruzi pyridine nucleotide-disulphide oxidoreductase, putative 0.0023 0.0183 0.0552
Loa Loa (eye worm) hypothetical protein 0.0009 0.0028 0.0084
Schistosoma mansoni sulfide quinone reductase 0.0023 0.0183 0.021
Schistosoma mansoni bromodomain containing protein 0.0062 0.062 0.0715
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0009 0.0028 0.0084
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0028 0.0032
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.028 0.3043 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0023 0.0183 0.06
Toxoplasma gondii thioredoxin reductase 0.0246 0.2667 1
Trypanosoma cruzi NADH dehydrogenase, putative 0.0023 0.0183 0.0552
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0625 0.687 1
Trichomonas vaginalis set domain proteins, putative 0.0232 0.2511 0.8253
Echinococcus granulosus Smad4 0.0008 0.0025 0.0049
Entamoeba histolytica hypothetical protein 0.0011 0.0055 0.018
Trichomonas vaginalis apoptosis inducing factor, putative 0.0023 0.0183 0.06
Trichomonas vaginalis conserved hypothetical protein 0.0011 0.0055 0.018
Loa Loa (eye worm) hypothetical protein 0.0011 0.0055 0.0166
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0231 0.076
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase family protein 0.0023 0.0183 0.0553
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0011 0.0022
Brugia malayi CXXC zinc finger family protein 0.0025 0.0206 0.0623
Schistosoma mansoni glutamate synthase 0.0023 0.0183 0.021
Loa Loa (eye worm) hypothetical protein 0.0068 0.0684 0.2072
Brugia malayi chromobox protein homolog 3 0.0038 0.0355 0.1076
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0085 0.0879 0.2659
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0085 0.0879 0.3155
Giardia lamblia NADH oxidase lateral transfer candidate 0.0085 0.0879 0.2435
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0085 0.0879 0.3155
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0017 0.0117 0.0385
Brugia malayi Bromodomain containing protein 0.0073 0.0745 0.2257
Plasmodium falciparum ferrodoxin reductase-like protein 0.0023 0.0183 0.0489
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0088 0.0911 0.105
Echinococcus multilocularis NADPH:adrenodoxin oxidoreductase 0.0023 0.0183 0.0183
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0023 0.0183 0.06
Mycobacterium tuberculosis Probable dehydrogenase 0.0562 0.6173 0.8958
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.0582 0.0582

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 6.4 uM Cytotoxicity against Homo sapiens (human) HeLa cells after 48 hr by MTT assay ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

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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