Detailed information for compound 230573

Basic information

Technical information
  • TDR Targets ID: 230573
  • Name: (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S, 6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan- 2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[ (E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3, 17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6 ,12,16-tetrone
  • MW: 766.92 | Formula: C41H58N4O10
  • H donors: 2 H acceptors: 7 LogP: 4.37 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: CC[C@H]1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C[C@H](C(=O)[C@@H]([C@@H]2[C@]1(C)OC(=O)N2)C)C)(C)OC/C=C/c1cnc2c(c1)nccc2
  • InChi: 1S/C41H58N4O10/c1-11-31-41(8)35(44-39(50)55-41)24(4)32(46)22(2)20-40(7,51-17-13-14-27-19-29-28(43-21-27)15-12-16-42-29)36(25(5)33(47)26(6)37(49)53-31)54-38-34(48)30(45(9)10)18-23(3)52-38/h12-16,19,21-26,30-31,34-36,38,48H,11,17-18,20H2,1-10H3,(H,44,50)/b14-13+/t22-,23-,24+,25+,26-,30+,31-,34-,35-,36-,38+,40-,41-/m1/s1
  • InChiKey: MBNYAXKOMHNVSW-JRCTUHHHSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)allyloxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)allyloxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-oxan-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)allyloxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-diquinone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-2-tetrahydropyranyl]oxy]-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-diquinone
  • (1S,2R,5R,7R,8R,9R,11R,13R,14R)-8-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyl-oxan-2-yl]oxy-2-ethyl-1,5,7,9,11,13-hexamethyl-9-[(E)-3-(1,5-naphthyridin-3-yl)prop-2-enoxy]-3,17-dioxa-15-azabicyclo[12.3.0]heptadecane-4,6,12,16-tetrone

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
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0023 0.0288 0.1913
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0033 0.0033
Onchocerca volvulus 0.05 1 1
Loa Loa (eye worm) animal heme peroxidase 0.05 1 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0595 0.0591
Brugia malayi steroid hormone receptor 0.0011 0.0033 0.0033
Schistosoma mansoni hypothetical protein 0.0134 0.2547 0.2544
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0033 0.0033
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0023 0.0288 0.0599
Plasmodium falciparum glutathione reductase 0.0023 0.0288 0.2404
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.007 0.1247 1
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0595 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0595 0.4505
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0033 0.0033
Onchocerca volvulus 0.05 1 1
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0023 0.0288 0.0283
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0134 0.2547 0.2544
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0595 0.1238
Brugia malayi Animal haem peroxidase family protein 0.05 1 1
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0595 1
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0033 0.0028
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0033 0.0028
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0023 0.0288 0.0283
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0033 0.0028
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0033 0.0033
Brugia malayi ecdysteroid receptor 0.0011 0.0033 0.0033
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0033 0.0033
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.007 0.1247 0.1243
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0033 0.0028
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Loa Loa (eye worm) RecQ helicase 0.0023 0.0277 0.0277
Echinococcus multilocularis transcription factor Dp 1 0.0041 0.0643 0.0639
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0009 0.0005 0.0005
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0277 0.0277
Schistosoma mansoni hypothetical protein 0.018 0.3493 0.349
Echinococcus multilocularis thyroid hormone receptor alpha 0.0145 0.2767 0.2763
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0033 0.0033
Schistosoma mansoni hypothetical protein 0.0318 0.6306 0.6304
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0023 0.0288 0.0599
Loa Loa (eye worm) animal heme peroxidase 0.05 1 1
Loa Loa (eye worm) blistered cuticle protein 3 0.05 1 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.007 0.1247 0.1243
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Trichomonas vaginalis glutathione reductase, putative 0.0023 0.0288 0.4837
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0023 0.0288 0.4837
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.007 0.1247 0.1243
Plasmodium falciparum thioredoxin reductase 0.0067 0.1183 1
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Loa Loa (eye worm) animal heme peroxidase 0.05 1 1
Onchocerca volvulus 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0033 0.0033
Mycobacterium ulcerans lipase LipD 0.0038 0.0595 1
Mycobacterium tuberculosis Conserved protein 0.0038 0.0595 0.1238
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0033 0.0033
Plasmodium falciparum glutathione reductase 0.0067 0.1183 1
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0023 0.0288 0.1913
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0595 0.1238
Brugia malayi nuclear hormone receptor 0.0011 0.0033 0.0033
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0005 0.0005
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0033 0.0028
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Loa Loa (eye worm) hypothetical protein 0.0018 0.0183 0.0183
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0023 0.0288 0.1913
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Plasmodium falciparum thioredoxin reductase 0.0023 0.0288 0.2404
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0033 0.0028
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0033 0.0028
Trypanosoma brucei trypanothione reductase 0.0067 0.1183 0.9457
Brugia malayi glutathione reductase 0.0067 0.1183 0.1183
Echinococcus granulosus protein cereblon 0.0318 0.6306 0.6304
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0033 0.0028
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0595 0.4438
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0033 0.0028
Onchocerca volvulus 0.0038 0.0595 0.0595
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Schistosoma mansoni hypothetical protein 0.018 0.3493 0.349
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0033 0.0033
Echinococcus granulosus thioredoxin glutathione reductase 0.0067 0.1183 0.1178
Echinococcus granulosus bloom syndrome protein 0.0023 0.0277 0.0272
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0023 0.0288 0.1913
Onchocerca volvulus Peroxidase homolog 0.05 1 1
Brugia malayi Animal haem peroxidase family protein 0.05 1 1
Echinococcus granulosus geminin 0.018 0.3493 0.349
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0595 0.0595
Plasmodium vivax thioredoxin reductase, putative 0.0067 0.1183 1
Brugia malayi Thioredoxin reductase 0.0067 0.1183 0.1183
Onchocerca volvulus Chorion peroxidase homolog 0.05 1 1
Leishmania major trypanothione reductase 0.0067 0.1183 0.9457
Brugia malayi beta-lactamase family protein 0.0038 0.0595 0.0595
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0033 0.0033
Loa Loa (eye worm) glutathione reductase 0.0067 0.1183 0.1183
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Onchocerca volvulus 0.0038 0.0595 0.0595
Onchocerca volvulus 0.0038 0.0595 0.0595
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0595 0.1238
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0023 0.0288 0.1913
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0023 0.0288 0.1913
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0023 0.0288 0.5
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0023 0.0288 0.5
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.1247 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0595 1
Schistosoma mansoni thyroid hormone receptor 0.0145 0.2767 0.2763
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0023 0.0288 0.4837
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0033 0.0028
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0033 0.0033
Trichomonas vaginalis mercuric reductase, putative 0.0023 0.0288 0.4837
Brugia malayi Blistered cuticle protein 3 0.05 1 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Toxoplasma gondii NADPH-glutathione reductase 0.0023 0.0288 0.2404
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0023 0.0288 0.2404
Echinococcus multilocularis peroxidasin 0.05 1 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0067 0.1183 0.1178
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0005 0.0005
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0033 0.0028
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0595 0.4505
Mycobacterium tuberculosis Probable oxidoreductase 0.0023 0.0288 0.0599
Trichomonas vaginalis DNA helicase recq, putative 0.0012 0.0061 0.1027
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0005 0.00000000073963
Giardia lamblia Sgs1 DNA helicase, putative 0.0009 0.0005 0.017
Brugia malayi Animal haem peroxidase family protein 0.05 1 1
Onchocerca volvulus Protein cereblon homolog 0.0318 0.6306 0.6306
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0033 0.0028
Echinococcus granulosus transcription factor Dp 1 0.0041 0.0643 0.0639
Schistosoma mansoni peroxidasin 0.05 1 1
Toxoplasma gondii ABC1 family protein 0.0038 0.0595 0.5014
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0033 0.0033
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0595 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0033 0.0033
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0033 0.0028
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0595 0.4505
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0595 0.0591
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0595 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0033 0.0033
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0033 0.0033
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0033 0.0033
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0277 0.0272
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0277 0.4652
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0033 0.0033
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0033 0.0028
Trypanosoma cruzi trypanothione reductase, putative 0.0067 0.1183 0.9457
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0015 0.0123 0.1005
Treponema pallidum NADH oxidase 0.0023 0.0288 0.5
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Brugia malayi follicle stimulating hormone receptor 0.0247 0.4843 0.4843
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0033 0.0033
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Echinococcus granulosus peroxidasin 0.05 1 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0033 0.0028
Entamoeba histolytica hypothetical protein, conserved 0.0318 0.6306 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0033 0.0033
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0033 0.0028
Loa Loa (eye worm) hypothetical protein 0.0338 0.6702 0.6702
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0023 0.0288 0.1913
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0023 0.0288 0.0288
Leishmania major hypothetical protein, conserved 0.0038 0.0595 0.4505
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.0221 0.1832
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0595 0.1238
Onchocerca volvulus Peroxidasin homolog 0.05 1 1
Mycobacterium leprae conserved hypothetical protein 0.0038 0.0595 1
Mycobacterium ulcerans hypothetical protein 0.0038 0.0595 1
Brugia malayi Animal haem peroxidase family protein 0.05 1 1
Loa Loa (eye worm) animal heme peroxidase 0.05 1 1
Toxoplasma gondii thioredoxin reductase 0.0067 0.1183 1
Brugia malayi nuclear receptor NHR-88 0.0011 0.0033 0.0033
Mycobacterium ulcerans beta-lactamase 0.0038 0.0595 1
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0023 0.0288 0.2404
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.0288 0.1913
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0067 0.1183 0.2459
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0033 0.0028
Plasmodium vivax glutathione reductase, putative 0.0067 0.1183 1
Brugia malayi hypothetical protein 0.0318 0.6306 0.6306
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.007 0.1247 0.1247
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0023 0.0288 0.4837
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.007 0.1247 0.1899
Schistosoma mansoni peroxidasin 0.05 1 1
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0023 0.0288 0.1913
Schistosoma mansoni blooms syndrome DNA helicase 0.0018 0.0179 0.0175
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0033 0.0033
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0033 0.0028
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0033 0.0028
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0595 0.1238
Trypanosoma cruzi trypanothione reductase, putative 0.0023 0.0288 0.1913
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0023 0.0288 0.2404
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0023 0.0288 0.1526
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0033 0.0028
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0033 0.0028
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0595 0.0591
Giardia lamblia NADH oxidase lateral transfer candidate 0.0023 0.0288 1
Mycobacterium tuberculosis Conserved protein 0.0038 0.0595 0.1238
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0595 0.0595
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0595 1
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0023 0.0288 0.1526
Brugia malayi hypothetical protein 0.013 0.2457 0.2457
Brugia malayi beta-lactamase family protein 0.0038 0.0595 0.0595
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0595 0.0591
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0005 0.0005
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0017 0.0162 0.0162
Echinococcus multilocularis geminin 0.018 0.3493 0.349
Schistosoma mansoni thyroid hormone receptor 0.0145 0.2767 0.2763
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0277 0.4652
Trichomonas vaginalis esterase, putative 0.0038 0.0595 1
Echinococcus multilocularis protein cereblon 0.0318 0.6306 0.6304
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0033 0.0033
Brugia malayi Peroxidasin 0.05 1 1
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0595 0.1238
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0033 0.0028
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0023 0.0288 0.0283
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0023 0.0288 0.0599
Brugia malayi Animal haem peroxidase family protein 0.05 1 1
Loa Loa (eye worm) hypothetical protein 0.0011 0.0033 0.0033
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0033 0.0028
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.007 0.1247 0.1247
Loa Loa (eye worm) thioredoxin reductase 0.0067 0.1183 0.1183
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0033 0.0033
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0017 0.0162 0.0162
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0245 0.4808 1
Onchocerca volvulus Peroxidasin homolog 0.05 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0033 0.0033
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0595 0.1238
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.1247 1
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0023 0.0288 0.5
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0595 1
Brugia malayi beta-lactamase 0.0038 0.0595 0.0595
Loa Loa (eye worm) hypothetical protein 0.0038 0.0595 0.0595
Mycobacterium leprae Probable lipase LipE 0.0038 0.0595 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0033 0.0028
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.007 0.1247 1
Onchocerca volvulus Peroxidase homolog 0.05 1 1
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Loa Loa (eye worm) hypothetical protein 0.0318 0.6306 0.6306
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0247 0.4843 0.4843
Onchocerca volvulus 0.05 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0033 0.0028
Onchocerca volvulus Dual oxidase homolog 0.05 1 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0033 0.0028
Loa Loa (eye worm) hypothetical protein 0.05 1 1
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0134 0.2547 0.2544
Mycobacterium tuberculosis Conserved protein 0.0038 0.0595 0.1238
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0033 0.0028
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0033 0.0033
Schistosoma mansoni coup transcription factor 0.0011 0.0033 0.0028
Loa Loa (eye worm) beta-lactamase 0.0038 0.0595 0.0595

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 12.5 mg kg-1 Mouse protection tests for effective dose of the compound against S. aureus 10649 ((erythromycin susceptible strain)) infected mice ChEMBL. 11708916
ED50 (functional) = 12.5 mg kg-1 Mouse protection tests for effective dose of the compound against S. aureus 10649 ((erythromycin susceptible strain)) infected mice ChEMBL. 11708916
ED50 (functional) = 17.3 mg kg-1 Mouse protection tests for effective dose of the compound against S. pneumoniae 6303 ((erythromycin susceptible strain)) infected mice ChEMBL. 11708916
ED50 (functional) = 17.3 mg kg-1 Mouse protection tests for effective dose of the compound against S. pneumoniae 6303 ((erythromycin susceptible strain)) infected mice ChEMBL. 11708916
IC50 (functional) = 0.1 uM Cell free inhibiting activity against erythromycin-susceptible strain S. pneumoniae 1813 (Wild type ribosomes for transcription/translation assay) ChEMBL. 11708916
IC50 (functional) = 25 uM Cell free inhibiting activity against erythromycin-susceptible strain S. pneumoniae 1813 (methylated ribosomes for transcription/translation assay) ChEMBL. 11708916
MIC (functional) = 0.015 ug ml-1 Minimum inhibitory concentration against S. pneumoniae ATCC 6303 Ery-S ChEMBL. 11708916
MIC (functional) = 0.015 ug ml-1 Minimum inhibitory concentration against S. pneumoniae 6303 (erythromycin susceptible strain) ChEMBL. 11708916
MIC (functional) = 0.03 ug ml-1 Minimum inhibitory concentration against S. pyogenes EES 61 Ery-S ChEMBL. 11708916
MIC (functional) = 0.05 ug ml-1 Minimum inhibitory concentration against S. aureus ATCC 6538PEry-S ChEMBL. 11708916
MIC (functional) = 0.05 ug ml-1 Minimum inhibitory concentration against S. aureus A 5177 MLSB-i ChEMBL. 11708916
MIC (functional) = 0.05 ug ml-1 Minimum inhibitory concentration against S. aureus 10649 (erythromycin susceptible strain) ChEMBL. 11708916
MIC (functional) = 0.25 ug ml-1 Minimum inhibitory concentration against S. pneumoniae 5737 MLSB ChEMBL. 11708916
MIC (functional) = 0.5 ug ml-1 Minimum inhibitory concentration against S. pyogenes PIU2548 efflux ChEMBL. 11708916
MIC (functional) = 1 ug ml-1 Minimum inhibitory concentration against S. pneumoniae 5649 efflux ChEMBL. 11708916
MIC (functional) = 2 ug ml-1 Minimum inhibitory concentration against S. pyogenes 930MLSB ChEMBL. 11708916
MIC (functional) = 2 ug ml-1 Minimum inhibitory concentration against H. influenzae DILL Amp-R ChEMBL. 11708916
MIC (functional) > 100 ug ml-1 Minimum inhibitory concentration against S. aureus A 5278 MLSB-c ChEMBL. 11708916

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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