Detailed information for compound 1160061

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 638.749 | Formula: C38H42N2O7
  • H donors: 2 H acceptors: 2 LogP: 6.05 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1cc2c(c(c1O)Oc1ccc(cc1)C[C@@H]1N(C)CCc3c1cc(OC)c(c3)O)C[C@@H]1c3c2c(OC)c(OC)cc3CCN1C
  • InChi: 1S/C38H42N2O7/c1-39-13-11-22-16-30(41)31(43-3)19-25(22)28(39)15-21-7-9-24(10-8-21)47-37-27-18-29-34-23(12-14-40(29)2)17-33(45-5)38(46-6)35(34)26(27)20-32(44-4)36(37)42/h7-10,16-17,19-20,28-29,41-42H,11-15,18H2,1-6H3/t28-,29+/m0/s1
  • InChiKey: RRRBUQLZAIRJQZ-URLMMPGGSA-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
Brugia malayi TAR-binding protein 0.0065 0.0463 0.0463
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0375 0.4952 0.5048
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0063 0.043 0.0438
Brugia malayi bHLH-PAS transcription factor 0.011 0.1118 0.1118
Schistosoma mansoni thyroid hormone receptor 0.0192 0.2297 0.2342
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0063 0.0438 0.0748
Toxoplasma gondii cytochrome p450 superfamily protein 0.0083 0.0721 0.1237
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0063 0.043 0.043
Brugia malayi hypoxia-induced factor 1 0.0462 0.6207 0.6207
Trypanosoma brucei protein kinase, putative 0.0106 0.1052 0.1806
Loa Loa (eye worm) inositol-1 0.004 0.0101 0.0101
Echinococcus granulosus pyruvate kinase 0.0033 0.0003 0.0003
Brugia malayi cytoplasmic intermediate filament protein 0.0044 0.0161 0.0161
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0149 0.1682 0.289
Echinococcus multilocularis lamin 0.0083 0.0717 0.0731
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0043 0.0142 0.0239
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0083 0.0721 0.0733
Schistosoma mansoni sphingosine kinase A B 0.071 0.981 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0063 0.043 0.043
Echinococcus granulosus mitogen activated protein kinase 3 0.0106 0.1052 0.1072
Leishmania major cytochrome p450-like protein 0.0155 0.1758 0.3022
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0101 0.0169
Brugia malayi PAS domain containing protein 0.0149 0.168 0.168
Schistosoma mansoni aldehyde dehydrogenase 0.019 0.2267 0.2311
Brugia malayi Thioredoxin reductase 0.0085 0.075 0.075
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0149 0.1682 0.1715
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.004 0.0097 0.0099
Schistosoma mansoni microtubule-associated protein tau 0.0707 0.9756 0.9945
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0039 0.008 0.0133
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0216 0.2642 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0194 0.2328 0.2371
Trichomonas vaginalis conserved hypothetical protein 0.0149 0.1682 0.289
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0181 0.0184
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0043 0.0142 0.0239
Echinococcus granulosus sphingosine kinase 1 0.071 0.981 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0063 0.043 0.0438
Brugia malayi glutathione reductase 0.0085 0.075 0.075
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0129 0.1386 0.1413
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.008 0.0133
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0083 0.0721 0.1237
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0083 0.0721 0.0733
Mycobacterium tuberculosis Probable dehydrogenase 0.0194 0.2328 0.2371
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.0438 0.0446
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0039 0.008 0.0133
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0083 0.0721 0.0733
Onchocerca volvulus Bile acid receptor homolog 0.0063 0.043 0.1449
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0083 0.0721 0.0733
Loa Loa (eye worm) pyruvate kinase 0.0033 0.0003 0.0003
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0181 0.0181
Leishmania major protein kinase, putative 0.0043 0.0142 0.0239
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0063 0.043 0.0438
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0181 0.0184
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0106 0.1052 0.1052
Brugia malayi Intermediate filament tail domain containing protein 0.0083 0.0717 0.0717
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0063 0.043 0.0438
Echinococcus granulosus mitogen activated protein kinase 0.0106 0.1052 0.1072
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0063 0.043 0.043
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0083 0.0721 0.0733
Loa Loa (eye worm) hypothetical protein 0.043 0.575 0.575
Mycobacterium ulcerans aldehyde dehydrogenase 0.019 0.2267 0.2308
Loa Loa (eye worm) hypothetical protein 0.0494 0.6679 0.6679
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0106 0.1052 0.1806
Trichomonas vaginalis CMGC family protein kinase 0.0434 0.5812 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0063 0.043 0.0438
Echinococcus granulosus dual specificity protein kinase clk2 0.0434 0.5812 0.5924
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0149 0.1682 0.289
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0063 0.043 0.043
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0063 0.043 0.0438
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0149 0.1682 0.289
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0055 0.0319 0.0319
Schistosoma mansoni pyruvate kinase 0.0033 0.0003 0.0003
Brugia malayi hypothetical protein 0.0078 0.0644 0.0644
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.01 0.0102
Echinococcus multilocularis neuropeptide receptor A26 0.0468 0.6303 0.6425
Loa Loa (eye worm) cytochrome P450 family protein 0.0161 0.1846 0.1846
Onchocerca volvulus 0.0039 0.008 0.0263
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.1447 0.1447
Entamoeba histolytica hypothetical protein, conserved 0.071 0.981 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0078 0.0644 0.1103
Loa Loa (eye worm) pyruvate kinase 0.0033 0.0003 0.0003
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0039 0.008 0.0133
Loa Loa (eye worm) cytochrome P450 family protein 0.0155 0.1758 0.1758
Brugia malayi steroid hormone receptor 0.0063 0.043 0.043
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0149 0.1682 0.289
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0043 0.0142 0.0239
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0083 0.0721 0.1237
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.0101 0.0103
Loa Loa (eye worm) hypothetical protein 0.0072 0.0556 0.0556
Toxoplasma gondii thioredoxin reductase 0.0085 0.075 0.1287
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0063 0.043 0.043
Plasmodium vivax ataxin-2 like protein, putative 0.0078 0.0644 0.1103
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0194 0.2328 0.2371
Onchocerca volvulus 0.011 0.1118 0.3788
Giardia lamblia Kinase, CMGC MAPK 0.0106 0.1052 0.1806
Schistosoma mansoni single-minded 0.0149 0.168 0.1712
Brugia malayi Cytochrome P450 family protein 0.0083 0.0721 0.0721
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0083 0.0721 0.0733
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0083 0.0721 0.0733
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0463 0.0472
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0063 0.043 0.043
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0063 0.043 0.043
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0101 0.0979 0.0979
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0083 0.0721 0.0733
Brugia malayi ecdysteroid receptor 0.0063 0.043 0.043
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0101 0.0169
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0083 0.0721 0.0733
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0083 0.0721 0.0733
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0106 0.1052 0.1806
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0063 0.043 0.0438
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0434 0.5812 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0101 0.0169
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0106 0.1052 0.1806
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0129 0.1386 0.1413
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0149 0.1682 0.289
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0083 0.0721 0.0733
Leishmania major cytochrome p450-like protein 0.0083 0.0721 0.1237
Schistosoma mansoni coup transcription factor 0.0063 0.043 0.0438
Brugia malayi hypothetical protein 0.0494 0.6679 0.6679
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0035 0.0023 0.0024
Echinococcus granulosus Polycystic kidney disease protein 0.0063 0.0427 0.0435
Giardia lamblia Kinase, CMGC CLK 0.0434 0.5812 1
Brugia malayi Cytochrome P450 family protein 0.0155 0.1758 0.1758
Onchocerca volvulus 0.0063 0.043 0.1449
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0181 0.0184
Leishmania major protein kinase, putative 0.0434 0.5812 1
Loa Loa (eye worm) CYP4Cod1 0.0155 0.1758 0.1758
Echinococcus granulosus Aryl hydrocarbon receptor nuclear 0.0039 0.008 0.0082
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0063 0.043 0.0438
Loa Loa (eye worm) hypothetical protein 0.0083 0.0717 0.0717
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0083 0.0721 0.0733
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0083 0.0721 0.0733
Echinococcus granulosus lipoxygenase domain containing protein 0.0063 0.0427 0.0435
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0039 0.008 0.0133
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0149 0.1682 0.1715
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0083 0.0721 0.0733
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0083 0.0721 0.0733
Trichomonas vaginalis CMGC family protein kinase 0.0106 0.1052 0.1806
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0063 0.043 0.043
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0149 0.1682 0.1715
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0375 0.4952 0.5048
Trypanosoma brucei cytochrome P450, putative 0.0155 0.1758 0.3022
Mycobacterium ulcerans putative regulatory protein 0.011 0.1118 0.1137
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0083 0.0721 0.0733
Mycobacterium ulcerans aldehyde dehydrogenase 0.019 0.2267 0.2308
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0434 0.5812 1
Mycobacterium tuberculosis Probable reductase 0.0194 0.2328 0.2371
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0063 0.043 0.043
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0063 0.043 0.043
Echinococcus multilocularis transfer RNA-Lys 0.011 0.1118 0.114
Echinococcus multilocularis RUN 0.0063 0.0427 0.0435
Trichomonas vaginalis guanylate cyclase, putative 0.0039 0.008 0.0133
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0036 0.004 0.014
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0083 0.0721 0.0733
Echinococcus granulosus cytoplasmic intermediate filament protein 0.004 0.0097 0.0099
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0063 0.043 0.0438
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0063 0.043 0.043
Schistosoma mansoni inositol monophosphatase 0.004 0.0101 0.0103
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0063 0.043 0.043
Brugia malayi Steroid receptor seven-up type 2 0.0063 0.043 0.043
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Loa Loa (eye worm) hypothetical protein 0.05 0.6769 0.6769
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0434 0.5812 1
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0083 0.0721 0.0733
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.019 0.2267 0.2311
Echinococcus multilocularis neuropeptide s receptor 0.0468 0.6303 0.6425
Brugia malayi hypothetical protein 0.0063 0.0427 0.0427
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0063 0.043 0.043
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0083 0.0721 0.1237
Mycobacterium tuberculosis Conserved protein 0.071 0.981 1
Brugia malayi hypothetical protein 0.005 0.0245 0.0245
Loa Loa (eye worm) hypothetical protein 0.0063 0.0427 0.0427
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0149 0.1682 0.1715
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.008 0.0133
Echinococcus granulosus tumor protein p63 0.0341 0.4463 0.4549
Brugia malayi hypothetical protein 0.0063 0.0427 0.0427
Loa Loa (eye worm) hypothetical protein 0.0038 0.0075 0.0075
Echinococcus granulosus ecdysone induced protein 78C 0.0063 0.043 0.0438
Mycobacterium leprae Possible regulatory protein 0.0039 0.008 0.0293
Brugia malayi hypothetical protein 0.004 0.01 0.01
Echinococcus granulosus cytochrome P450 2K1 0.0083 0.0721 0.0735
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0083 0.0721 0.0733
Schistosoma mansoni steroid hormone receptor ad4bp 0.0063 0.043 0.0438
Onchocerca volvulus Protein ultraspiracle homolog 0.0063 0.043 0.1449
Trypanosoma cruzi cytochrome P450, putative 0.0155 0.1758 0.3022
Echinococcus multilocularis lipoxygenase domain containing protein 0.0063 0.0427 0.0435
Echinococcus granulosus RUN 0.0063 0.0427 0.0435
Loa Loa (eye worm) hypothetical protein 0.0038 0.0075 0.0075
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0083 0.0721 0.0733
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0063 0.043 0.0438
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0106 0.1052 0.1806
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.004 0.0101 0.5
Onchocerca volvulus 0.0063 0.0427 0.144
Echinococcus granulosus tar DNA binding protein 0.0065 0.0463 0.0472
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0083 0.0721 0.0733
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.004 0.0101 0.0169
Trypanosoma cruzi trypanothione reductase, putative 0.0085 0.075 0.1287
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.004 0.0101 0.01
Echinococcus granulosus FTZ F1 alpha 0.0063 0.043 0.0438
Brugia malayi cytochrome P450 0.0083 0.0721 0.0721
Loa Loa (eye worm) hypothetical protein 0.0081 0.0695 0.0695
Echinococcus granulosus survival motor neuron protein 1 0.0494 0.6679 0.6808
Echinococcus granulosus lamin dm0 0.0083 0.0717 0.0731
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0063 0.043 0.0438
Brugia malayi nuclear receptor NHR-88 0.0063 0.043 0.043
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0083 0.0721 0.0733
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0044 0.0161 0.0161
Schistosoma mansoni polycystin 1-related 0.0063 0.0427 0.0435
Loa Loa (eye worm) hypothetical protein 0.0039 0.008 0.008
Loa Loa (eye worm) pyruvate kinase 0.0033 0.0003 0.0003
Echinococcus multilocularis musashi 0.0083 0.0717 0.0731
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0063 0.0438 0.0438
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0463 0.0463
Echinococcus multilocularis pyruvate kinase 0.0033 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0106 0.1052 0.1806
Trypanosoma brucei PAB1-binding protein , putative 0.0078 0.0644 0.1103
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0181 0.0184
Echinococcus granulosus aryl hydrocarbon receptor 0.0039 0.008 0.0082
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0149 0.1682 0.1629
Schistosoma mansoni rab6-interacting 0.0063 0.0427 0.0435
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0155 0.1758 0.179
Loa Loa (eye worm) thioredoxin reductase 0.0085 0.075 0.075
Echinococcus multilocularis lipoxygenase domain containing protein 0.0063 0.0427 0.0435
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0063 0.043 0.0438
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0083 0.0721 0.1237
Echinococcus multilocularis Polycystic kidney disease protein 0.0063 0.0427 0.0435
Schistosoma mansoni cytochrome P450 0.0083 0.0721 0.0735
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0083 0.0721 0.0733
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.01 0.0963 0.0963
Schistosoma mansoni inositol monophosphatase 0.004 0.0101 0.0103
Echinococcus granulosus hypothetical protein 0.043 0.575 0.5862
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.0438 0.0443
Echinococcus multilocularis aryl hydrocarbon receptor 0.0039 0.008 0.0082
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0083 0.0721 0.1237
Loa Loa (eye worm) hypothetical protein 0.0063 0.0427 0.0427
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0083 0.0721 0.0733
Schistosoma mansoni serine/threonine protein kinase 0.0434 0.5812 0.5924
Loa Loa (eye worm) hypothetical protein 0.0068 0.0506 0.0506
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0063 0.043 0.043
Schistosoma mansoni hypothetical protein 0.0035 0.0023 0.0024
Echinococcus multilocularis microtubule associated protein 2 0.0707 0.9756 0.9945
Schistosoma mansoni loxhd1 0.0063 0.0427 0.0435
Echinococcus granulosus neuropeptide s receptor 0.0468 0.6303 0.6425
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0149 0.1682 0.289
Schistosoma mansoni hypothetical protein 0.0083 0.0721 0.0735
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0463 0.0463
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0063 0.043 0.0438
Trichomonas vaginalis CMGC family protein kinase 0.0106 0.1052 0.1806
Echinococcus granulosus single minded 2 0.011 0.1118 0.114
Trichomonas vaginalis set domain proteins, putative 0.0237 0.2947 0.5068
Leishmania major hypothetical protein, conserved 0.0078 0.0644 0.1103
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0149 0.1682 0.1715
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0463 0.0472
Schistosoma mansoni pyruvate kinase 0.0033 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0083 0.0721 0.0733
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0083 0.0721 0.0733
Mycobacterium tuberculosis Probable oxidoreductase 0.0216 0.2642 0.2691
Entamoeba histolytica myo-inositol monophosphatase, putative 0.004 0.0101 0.0001
Schistosoma mansoni nuclear hormone receptor 0.0063 0.043 0.0438
Brugia malayi latrophilin 2 splice variant baaae 0.0068 0.0506 0.0506
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.019 0.2267 0.2311
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0036 0.004 0.0038
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0083 0.0721 0.0733
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0063 0.0438 0.0446
Plasmodium falciparum protein serine/threonine kinase-1 0.0434 0.5812 1
Schistosoma mansoni aryl hydrocarbon receptor 0.0149 0.168 0.1712
Toxoplasma gondii cell-cycle-associated protein kinase CLK, putative 0.0434 0.5812 1
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0083 0.0721 0.0733
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0463 0.0472
Schistosoma mansoni retinoic acid receptor RXR 0.0063 0.043 0.0438
Schistosoma mansoni RAR-like nuclear receptor 0.0063 0.043 0.0438
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0083 0.0721 0.0733
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0063 0.0438 0.0446
Schistosoma mansoni lamin 0.0083 0.0717 0.0731
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0083 0.0721 0.0733
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0216 0.2642 0.2691
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.01 0.0102
Trichomonas vaginalis adenylate cyclase, putative 0.0039 0.008 0.0133
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0083 0.0721 0.0733
Echinococcus multilocularis tumor protein p63 0.0341 0.4463 0.4549
Trypanosoma brucei kinetoplastid kinetochore protein 19 0.0434 0.5812 1
Schistosoma mansoni sphingoid long chain base kinase 0.071 0.981 1
Echinococcus granulosus ubiquitin specific protease 41 0.0149 0.1682 0.1715
Echinococcus multilocularis 0.0083 0.0721 0.0735
Brugia malayi Pyruvate kinase, muscle isozyme 0.0033 0.0003 0.0003
Onchocerca volvulus 0.0063 0.0427 0.144
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0723 1 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0216 0.2642 0.2691
Trichomonas vaginalis CMGC family protein kinase 0.0106 0.1052 0.1806
Brugia malayi Nuclear hormone receptor-like 1 0.0063 0.043 0.043
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0181 0.0181
Echinococcus granulosus pyruvate kinase 0.0033 0.0003 0.0003
Trypanosoma cruzi cytochrome P450, putative 0.0155 0.1758 0.3022
Trypanosoma brucei trypanothione reductase 0.0085 0.075 0.1287
Loa Loa (eye worm) hypoxia-induced factor 1 0.0462 0.6207 0.6207
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0101 0.0169
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0463 0.0463
Mycobacterium leprae putative cytochrome p450 0.0083 0.0721 0.2722
Brugia malayi MH2 domain containing protein 0.0133 0.1447 0.1447
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0039 0.008 0.0133
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0063 0.0438 0.0443
Loa Loa (eye worm) glutathione reductase 0.0085 0.075 0.075
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0106 0.1052 0.1806
Brugia malayi MAP kinase sur-1 0.0106 0.1052 0.1052
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0208 0.2531 0.2531
Schistosoma mansoni hypothetical protein 0.0068 0.0506 0.0516
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0063 0.043 0.0438
Schistosoma mansoni hypothetical protein 0.0129 0.1386 0.1413
Echinococcus granulosus lamin 0.0083 0.0717 0.0731
Echinococcus multilocularis thioredoxin glutathione reductase 0.0086 0.0758 0.0772
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0063 0.043 0.1449
Loa Loa (eye worm) hypothetical protein 0.004 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.01 0.0963 0.0963
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0083 0.0721 0.0733
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0083 0.0721 0.0733
Echinococcus granulosus lipoxygenase domain containing protein 0.0063 0.0427 0.0435
Loa Loa (eye worm) doublecortin family protein 0.0063 0.0427 0.0427
Schistosoma mansoni serine/threonine protein kinase 0.0434 0.5812 0.5924
Loa Loa (eye worm) intermediate filament protein 0.0083 0.0717 0.0717
Brugia malayi Cytochrome P450 family protein 0.0161 0.1846 0.1846
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0194 0.2328 0.2371
Schistosoma mansoni hypothetical protein 0.004 0.01 0.0102
Brugia malayi Cytochrome P450 family protein 0.0155 0.1758 0.1758
Echinococcus granulosus neuropeptide receptor A26 0.0468 0.6303 0.6425
Leishmania major protein kinase, putative 0.0434 0.5812 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0083 0.0721 0.0733
Brugia malayi Pre-SET motif family protein 0.0208 0.2531 0.2531
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0063 0.043 0.043
Echinococcus granulosus inositol monophosphatase 1 0.004 0.0101 0.0103
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0039 0.008 0.0133
Loa Loa (eye worm) cytochrome P450 family protein 0.0155 0.1758 0.1758
Echinococcus multilocularis mitogen activated protein kinase 0.0106 0.1052 0.1072
Brugia malayi Calcitonin receptor-like protein seb-1 0.01 0.0963 0.0963
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0063 0.0438 0.0443
Schistosoma mansoni lipoxygenase 0.0375 0.4952 0.5048
Onchocerca volvulus 0.0083 0.0717 0.2425
Plasmodium falciparum glutathione reductase 0.0085 0.075 0.1287
Loa Loa (eye worm) hypothetical protein 0.0149 0.1682 0.1682
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0063 0.043 0.0438
Echinococcus granulosus microtubule associated protein 2 0.0707 0.9756 0.9945
Schistosoma mansoni lipoxygenase 0.0262 0.3317 0.3381
Schistosoma mansoni survival motor neuron protein 0.0101 0.0979 0.0998
Plasmodium vivax thioredoxin reductase, putative 0.0085 0.075 0.1287
Echinococcus multilocularis sphingosine kinase 1 0.071 0.981 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0003 0.0003
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0063 0.043 0.0438
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0463 0.0472
Mycobacterium leprae Conserved hypothetical protein 0.0083 0.0721 0.2722
Trichomonas vaginalis CMGC family protein kinase 0.0106 0.1052 0.1806
Echinococcus multilocularis Aryl hydrocarbon receptor nuclear 0.0039 0.008 0.0082
Plasmodium falciparum LCCL domain-containing protein 0.0063 0.0427 0.073
Loa Loa (eye worm) hypothetical protein 0.005 0.0242 0.0242
Plasmodium vivax multidomain scavenger receptor, putative 0.0063 0.0427 0.073
Brugia malayi Protein kinase domain containing protein 0.0434 0.5812 0.5812
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0035 0.0023 0.0024
Onchocerca volvulus 0.0101 0.0979 0.3316
Loa Loa (eye worm) hypothetical protein 0.071 0.981 0.981
Onchocerca volvulus 0.0083 0.0717 0.2425
Plasmodium vivax serine/threonine kinase-1, putative 0.0434 0.5812 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0181 0.0184
Loa Loa (eye worm) cytochrome P450 0.0083 0.0721 0.0721
Loa Loa (eye worm) pigment dispersing factor receptor c 0.01 0.0963 0.0963
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0063 0.043 0.0438
Loa Loa (eye worm) aryl Hydrocarbon receptor Associated protein family member 0.0039 0.008 0.008
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0063 0.043 0.043
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0101 0.0169
Trichomonas vaginalis inositol monophosphatase, putative 0.004 0.0101 0.0169
Echinococcus multilocularis pyruvate kinase 0.0033 0.0003 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.008 0.0133
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0149 0.1682 0.1715
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0063 0.043 0.0438
Brugia malayi nuclear hormone receptor 0.0063 0.043 0.043
Brugia malayi RNA binding protein 0.0065 0.0463 0.0463
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0434 0.5812 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.019 0.2267 0.3897
Loa Loa (eye worm) RNA binding protein 0.0065 0.0463 0.0463
Echinococcus multilocularis dual specificity protein kinase clk2 0.0434 0.5812 0.5924
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0194 0.2328 0.8812
Schistosoma mansoni transcription factor LCR-F1 0.004 0.01 0.0102
Toxoplasma gondii aldehyde dehydrogenase 0.019 0.2267 0.3897
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0083 0.0721 0.0733
Leishmania major protein kinase, putative 0.0043 0.0142 0.0239
Mycobacterium ulcerans aldehyde dehydrogenase 0.019 0.2267 0.2308
Echinococcus multilocularis ubiquitin specific protease 41 0.0149 0.1682 0.1715
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0083 0.0721 0.0733
Loa Loa (eye worm) steroid hormone receptor 0.0063 0.043 0.043
Echinococcus multilocularis survival motor neuron protein 1 0.0494 0.6679 0.6808
Schistosoma mansoni hypothetical protein 0.0063 0.0427 0.0435
Loa Loa (eye worm) hypothetical protein 0.0078 0.0644 0.0644
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0083 0.0717 0.0717
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0463 0.0472
Echinococcus multilocularis lamin dm0 0.0083 0.0717 0.0731
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0063 0.043 0.043
Brugia malayi Doublecortin family protein 0.0063 0.0427 0.0427
Echinococcus multilocularis FTZ F1 alpha 0.0063 0.043 0.0438
Mycobacterium ulcerans hypothetical protein 0.071 0.981 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0194 0.2328 0.2371
Echinococcus multilocularis mitogen activated protein kinase 3 0.0106 0.1052 0.1072
Schistosoma mansoni intermediate filament proteins 0.0083 0.0717 0.0731
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0063 0.043 0.0438
Echinococcus multilocularis thyroid hormone receptor alpha 0.0192 0.2297 0.2342
Trichomonas vaginalis guanylate cyclase, putative 0.0039 0.008 0.0133
Trypanosoma cruzi PAB1-binding protein , putative 0.0078 0.0644 0.1103
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0181 0.0184
Echinococcus granulosus thioredoxin glutathione reductase 0.0086 0.0758 0.0772
Trypanosoma cruzi STE group serine/threonine-protein kinase, putative 0.0043 0.0142 0.0239
Echinococcus multilocularis 0.043 0.575 0.5862
Echinococcus granulosus intermediate filament protein 0.0083 0.0717 0.0731
Schistosoma mansoni lamin 0.0083 0.0717 0.0731
Chlamydia trachomatis two component regulatory system sensor histidine kinase 0.0039 0.008 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0063 0.043 0.043
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0083 0.0721 0.0733
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0106 0.1052 0.1806
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0039 0.008 0.0133
Trypanosoma cruzi PAB1-binding protein , putative 0.0078 0.0644 0.1103
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0063 0.043 0.043
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0149 0.1682 0.289
Schistosoma mansoni hypothetical protein 0.0101 0.0979 0.0998
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0463 0.0472
Brugia malayi Pyruvate kinase, M2 isozyme 0.0033 0.0003 0.0003
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0085 0.075 0.0762
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.019 0.2267 0.2308
Plasmodium falciparum thioredoxin reductase 0.0085 0.075 0.1287
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.1447 0.1447
Schistosoma mansoni serine/threonine protein kinase 0.0106 0.1052 0.1072
Plasmodium vivax glutathione reductase, putative 0.0085 0.075 0.1287
Onchocerca volvulus 0.0237 0.2947 1
Loa Loa (eye worm) CMGC/CLK protein kinase 0.0434 0.5812 0.5812
Leishmania major cytochrome p450-like protein 0.0083 0.0721 0.1237
Onchocerca volvulus 0.005 0.0242 0.0813
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0083 0.0721 0.0733
Schistosoma mansoni rab6-interacting 0.0063 0.0427 0.0435
Schistosoma mansoni aldehyde dehydrogenase 0.019 0.2267 0.2311
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0149 0.1682 0.1682
Leishmania major trypanothione reductase 0.0085 0.075 0.1287
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0063 0.043 0.0438
Brugia malayi intermediate filament protein 0.0083 0.0717 0.0717
Schistosoma mansoni cellular tumor antigen P53 0.005 0.0242 0.0247
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0063 0.043 0.043
Trypanosoma brucei kinetoplastid kinetochore protein 10 0.0434 0.5812 1
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0106 0.1052 0.1806
Brugia malayi hypothetical protein 0.05 0.6769 0.6769
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0083 0.0721 0.0733
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0063 0.043 0.043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0181 0.0184
Brugia malayi Inositol-1 0.004 0.0101 0.0101
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0039 0.008 0.0133
Plasmodium falciparum ataxin-2 like protein, putative 0.0078 0.0644 0.1103
Schistosoma mansoni thyroid hormone receptor 0.0192 0.2297 0.2342
Toxoplasma gondii LsmAD domain-containing protein 0.0078 0.0644 0.1103
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0101 0.0169
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0083 0.0721 0.0733
Loa Loa (eye worm) hypothetical protein 0.0063 0.043 0.043

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 11.2 mg/ml Antimalarial activity against Plasmodium falciparum ChEMBL. 19299148

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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