Detailed information for compound 935967

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 619.774 | Formula: C33H41N5O5S
  • H donors: 4 H acceptors: 6 LogP: 3.65 Rotable bonds: 15
    Rule of 5 violations (Lipinski): 2
  • SMILES: O[C@@H]1C[C@H](N(C1)C(=O)[C@H](C(C)(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C)C(=O)NCc1ccc(cc1)c1scnc1C
  • InChi: 1S/C33H41N5O5S/c1-20-28(44-19-35-20)24-13-11-23(12-14-24)17-34-31(42)27-16-25(40)18-38(27)32(43)29(33(3,4)5)37-30(41)26(36-21(2)39)15-22-9-7-6-8-10-22/h6-14,19,25-27,29,40H,15-18H2,1-5H3,(H,34,42)(H,36,39)(H,37,41)/t25-,26+,27+,29-/m1/s1
  • InChiKey: ALYDGEQICGMVIP-UYIZUTNXSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens von Hippel-Lindau tumor suppressor, E3 ubiquitin protein ligase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_134630 All targets in OG5_134630
Onchocerca volvulus Get druggable targets OG5_134630 All targets in OG5_134630
Brugia malayi hypothetical protein Get druggable targets OG5_134630 All targets in OG5_134630
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
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0085 0.0139
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0169 0.5893
Giardia lamblia Heat shock protein HSP 90-alpha 0.0032 0.0267 1
Plasmodium falciparum glutathione reductase 0.0016 0.0029 0.0094
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0009
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.1586 0.2588
Echinococcus granulosus neuropeptide receptor A26 0.0449 0.6631 0.6624
Schistosoma mansoni thyroid hormone receptor 0.002 0.0085 0.0066
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0085 0.0066
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0016 0.0029 0.0094
Onchocerca volvulus Protein ultraspiracle homolog 0.002 0.0085 0.0027
Schistosoma mansoni hypothetical protein 0.0036 0.0328 0.0309
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0524 0.0855
Loa Loa (eye worm) doublecortin family protein 0.0019 0.0078 0.0127
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0085 0.0139
Brugia malayi hypothetical protein 0.0019 0.0078 0.0127
Brugia malayi hypothetical protein 0.0036 0.0328 0.0536
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.0159 0.2988
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.0944 1
Echinococcus granulosus geminin 0.0164 0.2294 0.2279
Brugia malayi hypothetical protein 0.0416 0.6126 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.002 0.0032
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0291 0.0474
Loa Loa (eye worm) hypothetical protein 0.0076 0.0944 0.154
Leishmania major hypothetical protein, conserved 0.0028 0.0221 0.4309
Trypanosoma cruzi hypothetical protein, conserved 0.0028 0.0221 0.4309
Brugia malayi nuclear hormone receptor 0.002 0.0085 0.0139
Brugia malayi photoreceptor-specific nuclear receptor 0.0249 0.3579 0.5843
Echinococcus multilocularis thioredoxin glutathione reductase 0.0046 0.0486 0.0467
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0085 0.0139
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0016 0.0029 0.0094
Echinococcus granulosus RUN 0.0019 0.0078 0.0058
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Schistosoma mansoni lamin 0.0026 0.0185 0.0166
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Schistosoma mansoni endoplasmin 0.0032 0.0267 0.0248
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0078 0.0058
Echinococcus multilocularis peptidase Clp (S14 family) 0.005 0.0545 0.0526
Echinococcus granulosus heat shock protein 0.0032 0.0267 0.0248
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Trichomonas vaginalis heat shock protein, putative 0.0032 0.0267 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0463 0.0756
Loa Loa (eye worm) hypothetical protein 0.0019 0.0078 0.0127
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0463 0.0444
Schistosoma mansoni hypothetical protein 0.0019 0.0078 0.0058
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0085 0.0066
Plasmodium falciparum thioredoxin reductase 0.0046 0.0486 0.5046
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0085 0.0139
Trypanosoma cruzi trypanothione reductase, putative 0.0016 0.0029 0.0186
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0029 0.0186
Trypanosoma cruzi trypanothione reductase, putative 0.0046 0.0486 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0016 0.0029 0.0094
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.002 0.0085 0.0027
Onchocerca volvulus Huntingtin homolog 0.0119 0.1599 0.5507
Loa Loa (eye worm) thioredoxin reductase 0.0046 0.0486 0.0793
Echinococcus granulosus heat shock protein 90 0.0032 0.0267 0.0248
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0016 0.0029 0.0056
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0159 0.1507
Echinococcus multilocularis lamin 0.0026 0.0185 0.0166
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0328 0.0309
Echinococcus granulosus neuropeptide s receptor 0.0449 0.6631 0.6624
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0085 0.0066
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0025 0.0169 0.015
Plasmodium falciparum cysteine repeat modular protein 1 0.0028 0.0221 0.2174
Entamoeba histolytica hypothetical protein 0.0036 0.0328 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0085 0.0139
Loa Loa (eye worm) glutathione reductase 0.0046 0.0486 0.0793
Onchocerca volvulus 0.0026 0.0185 0.0388
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0085 0.0066
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0085 0.0139
Brugia malayi Kringle domain containing protein 0.0028 0.0221 0.036
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.1586 0.2588
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0463 0.0444
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0085 0.0066
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.0159 0.1507
Entamoeba histolytica hypothetical protein 0.0036 0.0328 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0116 0.1561 1
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.0078 0.0058
Echinococcus granulosus intermediate filament protein 0.0026 0.0185 0.0166
Loa Loa (eye worm) hypothetical protein 0.0026 0.0178 0.0291
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0085 0.0139
Trypanosoma cruzi heat shock protein 90, putative 0.0032 0.0267 0.5305
Brugia malayi glutathione reductase 0.0046 0.0486 0.0793
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0016 0.0029 0.0094
Schistosoma mansoni rab6-interacting 0.0019 0.0078 0.0058
Echinococcus multilocularis heat shock protein 90 0.0025 0.0169 0.015
Brugia malayi Isocitrate dehydrogenase 0.0015 0.002 0.0033
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Schistosoma mansoni lipoxygenase 0.008 0.1007 0.0989
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0085 0.0139
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0016 0.0029 0.0186
Plasmodium falciparum glutathione reductase 0.0046 0.0486 0.5046
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0085 0.0066
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0105 0.1383 0.8844
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0026 0.0185 0.1708
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0159 0.2988
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Toxoplasma gondii thioredoxin reductase 0.0046 0.0486 0.5046
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0016 0.0029 0.0047
Brugia malayi nuclear receptor NHR-88 0.002 0.0085 0.0139
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0463 0.0444
Plasmodium vivax endoplasmin, putative 0.0032 0.0267 0.2677
Brugia malayi Protein kinase domain containing protein 0.0028 0.0221 0.036
Trichomonas vaginalis heat shock protein, putative 0.0019 0.0081 0.2204
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0267 0.5305
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Brugia malayi hypothetical protein 0.0016 0.0027 0.0044
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0016 0.0029 0.0186
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0085 0.0066
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0085 0.0066
Onchocerca volvulus Huntingtin homolog 0.0119 0.1599 0.5507
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Trypanosoma cruzi heat shock protein 90, putative 0.0025 0.0169 0.3203
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0085 0.0066
Onchocerca volvulus 0.0026 0.0185 0.0388
Trypanosoma cruzi heat shock protein 90, putative 0.0019 0.007 0.1075
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0085 0.0066
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0169 0.5893
Loa Loa (eye worm) hypothetical protein 0.0119 0.1599 0.2611
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0025 0.0169 0.1536
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0016 0.0029 0.0186
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0159 0.1507
Schistosoma mansoni microtubule-associated protein tau 0.067 1 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0085 0.0139
Mycobacterium tuberculosis Probable dehydrogenase 0.0105 0.1383 0.8844
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0085 0.0066
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0085 0.0066
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0085 0.0066
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0085 0.0139
Schistosoma mansoni heat shock protein 0.0032 0.0267 0.0248
Trypanosoma brucei trypanothione reductase 0.0046 0.0486 1
Plasmodium vivax thioredoxin reductase, putative 0.0046 0.0486 0.5046
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Onchocerca volvulus Bile acid receptor homolog 0.002 0.0085 0.0027
Plasmodium vivax glutathione reductase, putative 0.0046 0.0486 0.5046
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0463 0.0756
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Echinococcus multilocularis lamin dm0 0.0026 0.0185 0.0166
Brugia malayi steroid hormone receptor 0.002 0.0085 0.0139
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Echinococcus multilocularis geminin 0.0164 0.2294 0.2279
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0105 0.1383 0.872
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.002 0.0032
Leishmania major hypothetical protein, conserved 0.0024 0.0159 0.2988
Toxoplasma gondii hypothetical protein 0.0026 0.0185 0.1786
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0078 0.0058
Mycobacterium tuberculosis Probable reductase 0.0105 0.1383 0.8844
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0085 0.0139
Brugia malayi Doublecortin family protein 0.0019 0.0078 0.0127
Toxoplasma gondii NADPH-glutathione reductase 0.0016 0.0029 0.0094
Plasmodium falciparum thioredoxin reductase 0.0016 0.0029 0.0094
Onchocerca volvulus 0.002 0.0085 0.0027
Plasmodium falciparum heat shock protein 90 0.0032 0.0267 0.2677
Loa Loa (eye worm) hypothetical protein 0.0048 0.0524 0.0855
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0085 0.0139
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0463 0.0444
Mycobacterium tuberculosis Probable oxidoreductase 0.0116 0.1561 1
Trypanosoma cruzi Heat shock protein 83, putative 0.0032 0.0267 0.5305
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.0078 0.0628
Brugia malayi ecdysteroid receptor 0.002 0.0085 0.0139
Brugia malayi Latrophilin receptor protein 2 0.0015 0.002 0.0032
Onchocerca volvulus 0.0028 0.0221 0.0517
Giardia lamblia Heat shock protein HSP 90-alpha 0.0025 0.0169 0.5893
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0085 0.0139
Echinococcus multilocularis heat shock protein 90 0.0032 0.0267 0.0248
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0025 0.0169 0.3203
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0105 0.1383 0.8844
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0028 0.0221 0.2174
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0085 0.0066
Entamoeba histolytica hypothetical protein 0.0036 0.0328 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0076 0.0944 0.5565
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0025 0.0169 0.0969
Loa Loa (eye worm) hypothetical protein 0.0033 0.0291 0.0474
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0026 0.0185 0.1786
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0085 0.0066
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Schistosoma mansoni lamin 0.0026 0.0185 0.0166
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.0078 0.0628
Echinococcus multilocularis microtubule associated protein 2 0.067 1 1
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.0185 0.0303
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0114 0.1532 0.1515
Echinococcus granulosus FTZ F1 alpha 0.002 0.0085 0.0066
Loa Loa (eye worm) intermediate filament protein 0.0026 0.0185 0.0303
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0085 0.0066
Loa Loa (eye worm) hypothetical protein 0.0249 0.3579 0.5843
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0524 0.0855
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0267 0.5305
Echinococcus multilocularis tissue type plasminogen activator 0.0028 0.0221 0.0202
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0085 0.0066
Toxoplasma gondii kringle domain-containing protein 0.0028 0.0221 0.2174
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0085 0.0066
Schistosoma mansoni polycystin 1-related 0.0019 0.0078 0.0058
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0085 0.0139
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Brugia malayi intermediate filament protein 0.0026 0.0185 0.0303
Onchocerca volvulus 0.02 0.2841 1
Schistosoma mansoni coup transcription factor 0.002 0.0085 0.0066
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0085 0.0139
Echinococcus granulosus heat shock protein 90 0.0025 0.0169 0.015
Echinococcus granulosus lamin 0.0026 0.0185 0.0166
Trypanosoma cruzi heat shock protein 85, putative 0.0032 0.0267 0.5305
Schistosoma mansoni hypothetical protein 0.0028 0.0221 0.0202
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0076 0.0944 0.0926
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.005 0.0545 0.2699
Trichomonas vaginalis heat shock protein, putative 0.0025 0.0169 0.5893
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.002 0.0033
Loa Loa (eye worm) hypothetical protein 0.0416 0.6126 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0078 0.0058
Loa Loa (eye worm) hypothetical protein 0.0028 0.0221 0.036
Echinococcus multilocularis endoplasmin 0.0025 0.0169 0.015
Loa Loa (eye worm) endoplasmin 0.0032 0.0267 0.0436
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0076 0.0944 0.0926
Loa Loa (eye worm) hypothetical protein 0.0019 0.0078 0.0127
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Toxoplasma gondii heat shock protein HSP90 0.0032 0.0267 0.2677
Brugia malayi hypothetical protein 0.0119 0.1599 0.2611
Treponema pallidum heat shock protein 90 0.0025 0.0169 0.1536
Mycobacterium ulcerans heat shock protein 90 0.0025 0.0169 0.1536
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0026 0.0185 0.1786
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.0185 0.0303
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.0159 0.1507
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0085 0.0139
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0085 0.0139
Echinococcus granulosus endoplasmin 0.0025 0.0169 0.015
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0085 0.0066
Schistosoma mansoni rab6-interacting 0.0019 0.0078 0.0058
Echinococcus multilocularis heat shock protein 0.0032 0.0267 0.0248
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0105 0.1383 0.8844
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0085 0.0066
Schistosoma mansoni thyroid hormone receptor 0.002 0.0085 0.0066
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0085 0.0139
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.005 0.0545 0.3406
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Schistosoma mansoni intermediate filament proteins 0.0026 0.0185 0.0166
Echinococcus granulosus peptidase Clp S14 family 0.005 0.0545 0.0526
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.002 0.0032
Trypanosoma brucei heat shock protein 90, putative 0.0032 0.0267 0.5305
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0078 0.0058
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Brugia malayi hypothetical protein 0.0019 0.0078 0.0127
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139
Echinococcus granulosus lamin dm0 0.0026 0.0185 0.0166
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0085 0.0066
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Echinococcus multilocularis RUN 0.0019 0.0078 0.0058
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0016 0.0029 0.0186
Brugia malayi MH2 domain containing protein 0.0118 0.1586 0.2588
Brugia malayi isocitrate dehydrogenase 0.0015 0.002 0.0033
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0009
Leishmania major trypanothione reductase 0.0046 0.0486 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0159 0.026
Loa Loa (eye worm) hypothetical protein 0.0119 0.1599 0.2611
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0186
Schistosoma mansoni hypothetical protein 0.0033 0.0291 0.0271
Brugia malayi hypothetical protein 0.0024 0.0159 0.026
Trichomonas vaginalis endoplasmin, putative 0.0019 0.0081 0.2204
Schistosoma mansoni lipoxygenase 0.0114 0.1532 0.1515
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Schistosoma mansoni peptidase Clp (S14 family) 0.0076 0.0944 0.0926
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0076 0.0944 1
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0026 0.0185 0.0113
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.0078 0.0058
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0463 0.0444
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0328 0.0309
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0085 0.0139
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Loa Loa (eye worm) TK/ROR protein kinase 0.0028 0.0221 0.036
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0016 0.0029 0.0094
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0085 0.0139
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0186
Echinococcus granulosus tissue type plasminogen activator 0.0028 0.0221 0.0202
Plasmodium vivax heat shock protein 86, putative 0.0032 0.0267 0.2677
Plasmodium falciparum endoplasmin, putative 0.0019 0.0081 0.0663
Echinococcus granulosus thioredoxin glutathione reductase 0.0046 0.0486 0.0467
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0159 0.2988
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.005 0.0545 0.3406
Trypanosoma brucei heat shock protein 90, putative 0.0032 0.0267 0.5305
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Schistosoma mansoni loxhd1 0.0019 0.0078 0.0058
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0085 0.0066
Schistosoma mansoni hypothetical protein 0.0164 0.2294 0.2279
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0116 0.1561 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0085 0.0066
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0046 0.0486 0.3025
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0114 0.1532 0.1515
Schistosoma mansoni hypothetical protein 0.0164 0.2294 0.2279
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0116 0.1561 1
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Schistosoma mansoni heat shock protein 0.0032 0.0267 0.0248
Trypanosoma cruzi heat shock protein 85, putative 0.0025 0.0169 0.3203
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0085 0.0139
Schistosoma mansoni endoplasmin 0.0032 0.0267 0.0248
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0463 0.0444
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0076 0.0944 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0085 0.0139
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0085 0.0066
Brugia malayi Thioredoxin reductase 0.0046 0.0486 0.0793
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Echinococcus multilocularis neuropeptide receptor A26 0.0449 0.6631 0.6624
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0076 0.0944 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0085 0.0066
Giardia lamblia Grp94/Hsp90 0.0025 0.0169 0.5893
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0016 0.0029 0.0186
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0016 0.0029 0.0186
Loa Loa (eye worm) heat shock protein 90 0.0032 0.0267 0.0436
Trypanosoma brucei heat shock protein, putative 0.0032 0.0267 0.5305
Echinococcus multilocularis neuropeptide s receptor 0.0449 0.6631 0.6624
Entamoeba histolytica hypothetical protein 0.0036 0.0328 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0463 0.0444
Schistosoma mansoni nuclear hormone receptor 0.002 0.0085 0.0066
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0328 0.0309
Brugia malayi Endoplasmin precursor 0.0032 0.0267 0.0436
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.0085 0.0066
Brugia malayi Probable ClpP-like protease 0.0076 0.0944 0.154
Toxoplasma gondii heat shock protein 90, putative 0.0032 0.0267 0.2677
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0524 0.0855
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0105 0.1383 0.8844
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Echinococcus multilocularis musashi 0.0026 0.0185 0.0166
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0085 0.0139
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0016 0.0029 0.0009
Leishmania major heat shock protein 83-1 0.0032 0.0267 0.5305
Trypanosoma brucei Heat shock protein 83, putative 0.0032 0.0267 0.5305
Brugia malayi heat shock protein 90 0.0032 0.0267 0.0436
Loa Loa (eye worm) hypothetical protein 0.0026 0.0185 0.0303
Loa Loa (eye worm) hypothetical protein 0.002 0.0085 0.0139

Activities

Activity type Activity value Assay description Source Reference
Kd (binding) = 0.291 uM Binding affinity to N-terminal His6-tagged pVHL (54 to 213 amino acids) (unknown origin) expressed in Escherichia coli BL21 (DE3) by isothermal titration calorimetry ChEMBL. 25166285

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.