Detailed information for compound 1004076

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 593.46 | Formula: C28H33BrO9
  • H donors: 2 H acceptors: 5 LogP: 1.42 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C1O[C@@H]2C[C@@]3([C@H]1CO[C@]14C[C@@H]3[C@@]3([C@@]2(C)OC(=O)[C@@]3(O)CC[C@H]2[C@H]4C[C@@H](O)[C@@]3([C@]2(C)C(=O)C=CC3)Br)O1)C
  • InChi: 1S/C28H33BrO9/c1-22-11-19-24(3)28-16(22)10-27(38-28,35-12-15(22)20(32)36-19)14-9-18(31)25(29)7-4-5-17(30)23(25,2)13(14)6-8-26(28,34)21(33)37-24/h4-5,13-16,18-19,31,34H,6-12H2,1-3H3/t13-,14+,15-,16-,18+,19+,22+,23-,24-,25-,26-,27+,28-/m0/s1
  • InChiKey: SCKCZQOQOZUREM-UXRCMFBVSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0042 0.0015
Trypanosoma cruzi pyruvate kinase 2, putative 0.0035 0.0312 0.2763
Echinococcus granulosus pyruvate kinase 0.0035 0.0312 0.0961
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0068 0.069 0.2241
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2987 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0309 0.1034
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0098 0.0329
Loa Loa (eye worm) hypothetical protein 0.001 0.0027 0.0091
Echinococcus granulosus pyruvate kinase 0.0018 0.0119 0.0311
Brugia malayi steroid hormone receptor 0.0011 0.0042 0.0142
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0042 0.0051
Mycobacterium ulcerans lipase LipD 0.008 0.0827 1
Mycobacterium leprae Probable lipase LipE 0.008 0.0827 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0042 0.0142
Loa Loa (eye worm) hypothetical protein 0.0051 0.049 0.1642
Trypanosoma cruzi hypothetical protein, conserved 0.008 0.0827 1
Echinococcus multilocularis tar DNA binding protein 0.0271 0.2987 0.2968
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.008 0.0827 1
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0042 0.0051
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0042 0.0051
Mycobacterium tuberculosis Probable hydrolase 0.008 0.0827 0.095
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0036 0.0324 0.0022
Loa Loa (eye worm) beta-lactamase 0.008 0.0827 0.2767
Echinococcus granulosus methyl CpG binding domain protein 2 0.002 0.0138 0.0373
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0827 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0042 0.0015
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.049 0.1642
Schistosoma mansoni pyruvate kinase 0.0035 0.0312 0.0961
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0042 0.0142
Loa Loa (eye worm) hypothetical protein 0.0047 0.0445 0.1489
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.004 0.0371 0.4306
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.008 0.0827 0.095
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.001 0.0027 0.0091
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0371 0.3604
Schistosoma mansoni hypothetical protein 0.0018 0.0115 0.0297
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0312 0.1043
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0042 0.0142
Mycobacterium ulcerans hypothetical protein 0.008 0.0827 1
Mycobacterium ulcerans esterase/lipase LipP 0.008 0.0827 1
Mycobacterium leprae conserved hypothetical protein 0.008 0.0827 1
Echinococcus granulosus survival motor neuron protein 1 0.0265 0.2918 0.9766
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0042 0.0142
Mycobacterium tuberculosis Conserved protein 0.008 0.0827 0.095
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0042 0.0015
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0271 0.2987 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0042 0.0015
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Echinococcus granulosus tar DNA binding protein 0.0271 0.2987 1
Echinococcus granulosus GPCR family 2 0.0016 0.0098 0.024
Trypanosoma brucei pyruvate kinase 1, putative 0.0035 0.0312 0.2763
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0041 0.0382 0.0356
Schistosoma mansoni hypothetical protein 0.019 0.2067 0.6893
Brugia malayi Inositol-1 0.004 0.0371 0.1244
Mycobacterium tuberculosis Probable esterase LipL 0.008 0.0827 0.095
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.1553 0.5154
Echinococcus multilocularis geminin 0.019 0.2067 0.2046
Brugia malayi nuclear hormone receptor 0.0011 0.0042 0.0142
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0042 0.0142
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0042 0.0142
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0042 0.0051
Echinococcus granulosus pyruvate kinase 0.0035 0.0312 0.0961
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0042 0.0015
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0371 0.3604
Schistosoma mansoni hypothetical protein 0.0035 0.0309 0.0951
Schistosoma mansoni hypothetical protein 0.0016 0.0098 0.024
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0042 0.0142
Onchocerca volvulus 0.008 0.0827 0.3745
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0042 0.0071
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0312 0.1043
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0042 0.0142
Echinococcus multilocularis pyruvate kinase 0.0035 0.0312 0.0285
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.049 0.1642
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0042 0.0142
Trypanosoma brucei hypothetical protein, conserved 0.008 0.0827 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.008 0.0827 0.2767
Trichomonas vaginalis inositol monophosphatase, putative 0.004 0.0371 0.1162
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.004 0.0371 0.5
Trichomonas vaginalis esterase, putative 0.008 0.0827 1
Brugia malayi nuclear receptor NHR-88 0.0011 0.0042 0.0142
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.1553 0.153
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0042 0.0142
Schistosoma mansoni inositol monophosphatase 0.004 0.0371 0.1163
Brugia malayi PHD-finger family protein 0.0028 0.024 0.0802
Echinococcus granulosus pyruvate kinase 0.0018 0.0119 0.0311
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.1553 0.5154
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0042 0.0142
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0042 0.0051
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0042 0.0051
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0042 0.0142
Echinococcus granulosus zinc finger protein 0.0022 0.017 0.0484
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0144 0.1553 0.153
Echinococcus multilocularis GPCR, family 2 0.0016 0.0098 0.0071
Schistosoma mansoni hypothetical protein 0.0016 0.0098 0.024
Brugia malayi Bromodomain containing protein 0.0044 0.0413 0.1383
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0042 0.0071
Schistosoma mansoni hypothetical protein 0.019 0.2067 0.6893
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0098 0.0071
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0042 0.0142
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Brugia malayi beta-lactamase family protein 0.008 0.0827 0.2767
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0042 0.0142
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0312 0.1332
Loa Loa (eye worm) hypothetical protein 0.0265 0.2918 0.9769
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.002 0.0138 0.0111
Loa Loa (eye worm) DIX domain-containing protein 0.001 0.0027 0.0091
Brugia malayi hypothetical protein 0.001 0.0027 0.0091
Brugia malayi Bromodomain containing protein 0.0086 0.0889 0.2975
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Echinococcus multilocularis pyruvate kinase 0.0028 0.0228 0.0202
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Loa Loa (eye worm) hypothetical protein 0.0044 0.0414 0.1386
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Brugia malayi ecdysteroid receptor 0.0011 0.0042 0.0142
Onchocerca volvulus 0.0011 0.0042 0.0071
Brugia malayi hypothetical protein 0.0265 0.2918 0.9769
Loa Loa (eye worm) RNA binding protein 0.0271 0.2987 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0026 0.0209 0.0614
Loa Loa (eye worm) hypothetical protein 0.0081 0.0833 0.279
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0098 0.0329
Brugia malayi TAR-binding protein 0.0271 0.2987 1
Brugia malayi Pyruvate kinase, M2 isozyme 0.0035 0.0312 0.1043
Schistosoma mansoni pyruvate kinase 0.0035 0.0312 0.0961
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Toxoplasma gondii ABC1 family protein 0.008 0.0827 1
Brugia malayi DIX domain containing protein 0.001 0.0027 0.0091
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.0371 0.0345
Echinococcus multilocularis muscleblind protein 1 0.0171 0.1852 0.183
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0042 0.0051
Mycobacterium ulcerans beta-lactamase 0.008 0.0827 1
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0827 1
Schistosoma mansoni survival motor neuron protein 0.0054 0.0529 0.1695
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0042 0.0051
Mycobacterium tuberculosis Probable conserved lipoprotein 0.008 0.0827 0.095
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0042 0.0142
Mycobacterium tuberculosis Probable lipase LipE 0.008 0.0827 0.095
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0042 0.0071
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2987 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.1553 0.5154
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0042 0.0142
Onchocerca volvulus 0.0054 0.0529 0.235
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0144 0.1553 0.5199
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Trypanosoma cruzi pyruvate kinase 2, putative 0.0035 0.0312 0.2763
Schistosoma mansoni hypothetical protein 0.0016 0.0098 0.024
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0042 0.0051
Loa Loa (eye worm) hypothetical protein 0.0049 0.0469 0.1572
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.008 0.0827 0.095
Plasmodium falciparum pyruvate kinase 0.0035 0.0312 1
Mycobacterium tuberculosis Probable lipase LipD 0.008 0.0827 0.095
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0312 0.1332
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.0138 0.0373
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0138 0.0373
Trichomonas vaginalis penicillin-binding protein, putative 0.008 0.0827 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0042 0.0051
Loa Loa (eye worm) hypothetical protein 0.001 0.0027 0.0091
Loa Loa (eye worm) hypothetical protein 0.0024 0.0192 0.0643
Giardia lamblia Pyruvate kinase 0.0035 0.0312 1
Schistosoma mansoni zinc finger protein 0.0018 0.0115 0.0297
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.049 0.1642
Echinococcus multilocularis survival motor neuron protein 1 0.0265 0.2918 0.2898
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0042 0.0051
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0309 0.1034
Schistosoma mansoni bromodomain containing protein 0.0072 0.0737 0.2397
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0042 0.0051
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0042 0.0142
Echinococcus multilocularis zinc finger protein 0.0022 0.017 0.0144
Brugia malayi N-terminal motif family protein 0.0198 0.2162 0.7237
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2987 1
Echinococcus granulosus beta LACTamase domain containing family member 0.008 0.0827 0.2701
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0042 0.0051
Loa Loa (eye worm) PHD-finger family protein 0.0024 0.0184 0.0617
Loa Loa (eye worm) hypothetical protein 0.001 0.0027 0.0091
Trichomonas vaginalis D-aminoacylase, putative 0.008 0.0827 1
Trypanosoma brucei pyruvate kinase 1 0.0035 0.0312 0.2763
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0042 0.0142
Loa Loa (eye worm) pyruvate kinase 0.0035 0.0312 0.1043
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0042 0.0051
Onchocerca volvulus 0.008 0.0827 0.3745
Onchocerca volvulus 0.008 0.0827 0.3745
Brugia malayi RNA recognition motif domain containing protein 0.0271 0.2987 1
Echinococcus multilocularis pyruvate kinase 0.0018 0.0119 0.0092
Brugia malayi Pyruvate kinase, alpha/beta domain containing protein 0.0011 0.0036 0.0121
Loa Loa (eye worm) hypothetical protein 0.008 0.0827 0.2767
Echinococcus multilocularis muscleblind protein 0.0171 0.1852 0.183
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0042 0.0051
Schistosoma mansoni zinc finger protein 0.0022 0.017 0.0484
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0042 0.0142
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0042 0.0142
Loa Loa (eye worm) inositol-1 0.004 0.0371 0.1244
Plasmodium vivax hypothetical protein, conserved 0.008 0.0827 1
Trichomonas vaginalis penicillin-binding protein, putative 0.008 0.0827 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0042 0.0015
Loa Loa (eye worm) bromodomain containing protein 0.002 0.0146 0.0488
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0371 0.1162
Trypanosoma cruzi hypothetical protein, conserved 0.008 0.0827 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.008 0.0827 0.2767
Brugia malayi Pyruvate kinase, muscle isozyme 0.0035 0.0312 0.1043
Schistosoma mansoni pyruvate kinase 0.0018 0.0119 0.0311
Schistosoma mansoni coup transcription factor 0.0011 0.0042 0.0051
Echinococcus granulosus muscleblind protein 0.0171 0.1852 0.6167
Echinococcus granulosus pyruvate kinase 0.0018 0.0119 0.0311
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0042 0.0142
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0042 0.0051
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0144 0.1553 0.5154
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0138 0.0373
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0371 0.3604
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0042 0.0142
Echinococcus multilocularis pyruvate kinase 0.0035 0.0312 0.0285
Chlamydia trachomatis pyruvate kinase 0.0035 0.0312 0.5
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0041 0.0382 0.12
Toxoplasma gondii pyruvate kinase PyKII 0.0018 0.0119 0.1153
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0042 0.0051
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0198 0.2162 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0042 0.0051
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0513 0.5729 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0042 0.0142
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0371 0.3604
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0098 0.024
Loa Loa (eye worm) hypothetical protein 0.0198 0.2162 0.7237
Schistosoma mansoni hypothetical protein 0.0016 0.0098 0.024
Loa Loa (eye worm) hypothetical protein 0.0171 0.1852 0.6202
Leishmania major pyruvate kinase 0.0035 0.0312 0.2763
Schistosoma mansoni inositol monophosphatase 0.004 0.0371 0.1163
Echinococcus granulosus inositol monophosphatase 1 0.004 0.0371 0.1163
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.001 0.0027 0.0091
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0042 0.0051
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0042 0.0015
Brugia malayi regulator of G-protein signaling egl-10 0.001 0.0027 0.0091
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.0529 0.1771
Entamoeba histolytica myo-inositol monophosphatase, putative 0.004 0.0371 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0068 0.069 0.0665
Onchocerca volvulus Pyruvate kinase homolog 0.0035 0.0312 0.1332
Loa Loa (eye worm) pyruvate kinase-PB 0.0024 0.0192 0.0643
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0042 0.0051
Brugia malayi Muscleblind-like protein 0.0171 0.1852 0.6202
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2987 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0026 0.0209 0.0182
Echinococcus multilocularis beta LACTamase domain containing family member 0.008 0.0827 0.0801
Loa Loa (eye worm) hypothetical protein 0.0016 0.0098 0.0329
Echinococcus granulosus geminin 0.019 0.2067 0.6893
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0042 0.0015
Echinococcus granulosus fetal alzheimer antigen falz 0.0026 0.0209 0.0614
Brugia malayi beta-lactamase family protein 0.008 0.0827 0.2767
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0098 0.024
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0042 0.0142
Leishmania major hypothetical protein, conserved 0.008 0.0827 1
Brugia malayi RNA binding protein 0.0271 0.2987 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0312 0.1043
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0098 0.0071
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0098 0.0329
Loa Loa (eye worm) TAR-binding protein 0.0271 0.2987 1
Echinococcus granulosus histone lysine methyltransferase setb 0.002 0.0138 0.0373
Echinococcus multilocularis pyruvate kinase 0.0018 0.0119 0.0092
Schistosoma mansoni hypothetical protein 0.0024 0.0184 0.053
Echinococcus multilocularis pyruvate kinase 0.0018 0.0119 0.0092
Schistosoma mansoni tar DNA-binding protein 0.0271 0.2987 1
Leishmania major pyruvate kinase 0.0035 0.0312 0.2763
Schistosoma mansoni methyl-cpg binding protein mbd 0.002 0.0138 0.0373
Echinococcus multilocularis methyl CpG binding domain protein 2 0.002 0.0138 0.0111
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.008 0.0827 0.2701
Loa Loa (eye worm) hypothetical protein 0.002 0.0138 0.0461
Schistosoma mansoni hypothetical protein 0.0054 0.0529 0.1695
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.001 0.0027 0.0091
Brugia malayi beta-lactamase 0.008 0.0827 0.2767
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0042 0.0015
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0371 0.1162
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0042 0.0051
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0144 0.1553 0.5154
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0144 0.1553 0.5199
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0036 0.0324 0.0237
Plasmodium vivax pyruvate kinase, putative 0.0035 0.0312 0.2718
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.004 0.0371 0.1162
Loa Loa (eye worm) hypothetical protein 0.0171 0.1852 0.6202
Loa Loa (eye worm) hypothetical protein 0.0011 0.0042 0.0142
Mycobacterium tuberculosis Conserved protein 0.008 0.0827 0.095
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.008 0.0827 0.2701
Mycobacterium tuberculosis Conserved protein 0.008 0.0827 0.095
Toxoplasma gondii pyruvate kinase PyK1 0.0035 0.0312 0.3558
Brugia malayi hypothetical protein 0.001 0.0027 0.0091

Activities

Activity type Activity value Assay description Source Reference
ID50 (functional) = 0.71 ug ml-1 Cytotoxicity against human HeLa cells ChEMBL. No reference

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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