Detailed information for compound 105297

Basic information

Technical information
  • TDR Targets ID: 105297
  • Name: 6'-fluoro-2'-[[5-(trifluoromethyl)-1,3-benzot hiazol-2-yl]methyl]spiro[azetidine-4,4'-isoqu inoline]-1',2,3'-trione
  • MW: 449.378 | Formula: C20H11F4N3O3S
  • H donors: 1 H acceptors: 4 LogP: 2.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CC2(N1)C(=O)N(Cc1sc3c(n1)cc(cc3)C(F)(F)F)C(=O)c1c2cc(F)cc1
  • InChi: 1S/C20H11F4N3O3S/c21-10-2-3-11-12(6-10)19(7-15(28)26-19)18(30)27(17(11)29)8-16-25-13-5-9(20(22,23)24)1-4-14(13)31-16/h1-6H,7-8H2,(H,26,28)
  • InChiKey: QVTBUTYCMLEPQV-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.015 0.0998 0.3679
Schistosoma mansoni aryl hydrocarbon receptor 0.0048 0.0228 0.0228
Echinococcus granulosus single minded 2 0.0035 0.0134 0.0134
Schistosoma mansoni myelin transcription factor 1 myt1 0.0056 0.029 0.029
Schistosoma mansoni tar DNA-binding protein 0.0125 0.0811 0.0811
Echinococcus granulosus BC026374 protein S09 family 0.0064 0.0346 0.0346
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0227 0.1573 1
Echinococcus multilocularis alkaline phosphatase 0.0491 0.3561 0.3561
Brugia malayi hypothetical protein 0.0064 0.0346 0.1255
Onchocerca volvulus 0.0049 0.0239 0.1127
Loa Loa (eye worm) hypothetical protein 0.0026 0.0064 0.0218
Brugia malayi Carboxylesterase family protein 0.0064 0.0346 0.1255
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0084 0.0084
Brugia malayi RNA binding protein 0.0125 0.0811 0.2985
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0028 0.0086
Brugia malayi hypothetical protein 0.003 0.0094 0.032
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0201 0.138 0.5105
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0134 0.0799
Onchocerca volvulus 0.0064 0.0346 0.1829
Echinococcus granulosus intestinal type alkaline phosphatase 1 0.0491 0.3561 0.3561
Brugia malayi MH2 domain containing protein 0.0118 0.0753 0.2768
Echinococcus granulosus histone acetyltransferase MYST2 0.0056 0.029 0.029
Brugia malayi MAP kinase sur-1 0.0049 0.0238 0.0853
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0149 0.0891
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.0332 0.0332
Trypanosoma brucei protein kinase, putative 0.0049 0.0238 0.3319
Echinococcus multilocularis transfer RNA-Lys 0.0035 0.0134 0.0134
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0023 0.0037 0.0423
Mycobacterium ulcerans beta-lactamase 0.0035 0.0134 0.1826
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.1782
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0134 0.0134
Schistosoma mansoni ap endonuclease 0.0019 0.0008 0.0008
Loa Loa (eye worm) hypothetical protein 0.0049 0.0239 0.0868
Schistosoma mansoni BC026374 protein (S09 family) 0.0064 0.0346 0.0346
Echinococcus granulosus acetylcholinesterase 0.0376 0.2698 0.2698
Schistosoma mansoni alpha-glucosidase 0.0145 0.0959 0.0959
Echinococcus granulosus lamin 0.0027 0.0067 0.0067
Echinococcus multilocularis inositol monophosphatase 1 0.0111 0.07 0.07
Mycobacterium tuberculosis Carboxylesterase LipT 0.0064 0.0346 0.2157
Onchocerca volvulus 0.015 0.0998 0.6116
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.1136 0.1136
Schistosoma mansoni lamin 0.0027 0.0067 0.0067
Echinococcus granulosus para nitrobenzyl esterase 0.0064 0.0346 0.0346
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0566 0.0566
Echinococcus multilocularis mitogen activated protein kinase 0.0049 0.0238 0.0238
Toxoplasma gondii ABC1 family protein 0.0035 0.0134 0.1826
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0238 0.1453
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0169 0.1136 0.4199
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0099 0.0612 0.3863
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.0149 0.2035
Brugia malayi Glycosyl hydrolases family 31 protein 0.0037 0.0149 0.0523
Brugia malayi Bromodomain containing protein 0.0078 0.0451 0.1648
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0064 0.0346 0.2157
Loa Loa (eye worm) hypothetical protein 0.0027 0.0067 0.0232
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.008 0.0471 0.0471
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0111 0.07 1
Schistosoma mansoni alpha glucosidase 0.0037 0.0149 0.0149
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0023 0.0037 0.0187
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0149 0.0891
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0134 0.1826
Loa Loa (eye worm) hypothetical protein 0.0376 0.2698 1
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0134 0.0807
Giardia lamblia Kinase, CMGC MAPK 0.0049 0.0238 1
Brugia malayi RNA recognition motif domain containing protein 0.0125 0.0811 0.2985
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Echinococcus multilocularis acetylcholinesterase 0.0376 0.2698 0.2698
Brugia malayi hypoxia-induced factor 1 0.0148 0.0984 0.3627
Loa Loa (eye worm) carboxylesterase 0.0064 0.0346 0.1265
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0198 0.1359 0.1359
Brugia malayi mbt repeat family protein 0.0049 0.0239 0.0858
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0064 0.0346 0.0346
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0049 0.0239 0.1127
Onchocerca volvulus 0.0035 0.0134 0.044
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0064 0.0346 0.0346
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0566 0.0566
Echinococcus granulosus acetylcholinesterase 0.0376 0.2698 0.2698
Mycobacterium ulcerans carboxylesterase, LipT 0.0064 0.0346 0.4881
Echinococcus granulosus inositol monophosphatase 1 0.0111 0.07 0.07
Brugia malayi Pre-SET motif family protein 0.0029 0.0084 0.0283
Schistosoma mansoni alkaline phosphatase 0.0491 0.3561 0.3561
Mycobacterium tuberculosis Conserved protein 0.0035 0.0134 0.0807
Echinococcus granulosus neutral alpha glucosidase AB 0.0037 0.0149 0.0149
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0147 0.0147
Brugia malayi mbt repeat family protein 0.0049 0.0239 0.0858
Schistosoma mansoni tar DNA-binding protein 0.0125 0.0811 0.0811
Loa Loa (eye worm) hypothetical protein 0.004 0.0166 0.0599
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0023 0.0037 1
Brugia malayi Carboxylesterase family protein 0.0376 0.2698 1
Loa Loa (eye worm) hypothetical protein 0.0073 0.0418 0.1534
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0049 0.0238 0.0864
Loa Loa (eye worm) hypothetical protein 0.0056 0.029 0.1059
Echinococcus multilocularis L aminoadipate semialdehyde 0.008 0.0471 0.0471
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0008 0.0012
Brugia malayi Carboxylesterase family protein 0.0064 0.0346 0.1255
Loa Loa (eye worm) hypothetical protein 0.0127 0.0821 0.3031
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0056 0.029 0.1049
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0064 0.0346 0.0346
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0134 0.0134
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0084 0.0084
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0067 0.0232
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0134 0.1687
Schistosoma mansoni hypothetical protein 0.0255 0.1786 0.1786
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0056 0.029 0.029
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0566 0.0566
Schistosoma mansoni single-minded 0.0048 0.0228 0.0228
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0134 0.0799
Brugia malayi beta-lactamase family protein 0.0035 0.0134 0.0469
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.0332 0.0332
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0084 0.1102
Brugia malayi beta-lactamase family protein 0.0035 0.0134 0.0469
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0049 0.0238 0.3319
Schistosoma mansoni hypothetical protein 0.0021 0.0028 0.0028
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0134 0.1826
Echinococcus granulosus intermediate filament protein 0.0027 0.0067 0.0067
Trypanosoma brucei glucosidase, putative 0.0037 0.0149 0.2035
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0067 0.0232
Echinococcus granulosus caspase 2 0.003 0.0094 0.0094
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.0149 0.0891
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0111 0.07 1
Brugia malayi hypothetical protein 0.0161 0.1078 0.3976
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0131 0.0131
Echinococcus granulosus alkaline phosphatase intestinal gene 2 0.0491 0.3561 0.3561
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0238 0.1453
Onchocerca volvulus 0.0064 0.0346 0.1829
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.0239 0.0239
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0217 0.0217
Echinococcus multilocularis apoptotic protease activating factor 1 0.003 0.0094 0.0094
Onchocerca volvulus Huntingtin homolog 0.0127 0.0821 0.4955
Onchocerca volvulus 0.008 0.0471 0.2657
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0023 0.0037 0.0423
Echinococcus multilocularis intestinal type alkaline phosphatase 1 0.0491 0.3561 0.3561
Echinococcus granulosus neuropeptide receptor A26 0.0457 0.3308 0.3308
Entamoeba histolytica hypothetical protein 0.0023 0.0037 0.0423
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0134 0.0807
Brugia malayi Inositol-1 0.0111 0.07 0.2572
Trypanosoma brucei hypothetical protein, conserved 0.0023 0.0037 0.0423
Brugia malayi TAR-binding protein 0.0125 0.0811 0.2985
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0064 0.0346 0.2157
Onchocerca volvulus 0.0064 0.0346 0.1829
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0099 0.0612 1
Brugia malayi PAS domain containing protein 0.0048 0.0228 0.0818
Echinococcus granulosus intestinal type alkaline phosphatase 0.0491 0.3561 0.3561
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0566 0.0566
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0049 0.0238 0.3319
Schistosoma mansoni neuroligin 3 (S09 family) 0.0064 0.0346 0.0346
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0149 0.0891
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0149 0.2035
Trichomonas vaginalis spcc417.12 protein, putative 0.0064 0.0346 0.2136
Brugia malayi Bromodomain containing protein 0.004 0.0165 0.0586
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.0566 0.2073
Schistosoma mansoni zinc finger protein 0.002 0.002 0.002
Schistosoma mansoni microtubule-associated protein tau 0.1347 1 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0111 0.07 1
Loa Loa (eye worm) hypothetical protein 0.008 0.0471 0.1733
Brugia malayi Carboxylesterase family protein 0.0376 0.2698 1
Onchocerca volvulus 0.0035 0.0134 0.044
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0239 0.0239
Echinococcus multilocularis intestinal type alkaline phosphatase 0.0491 0.3561 0.3561
Echinococcus granulosus histone lysine methyltransferase setb 0.0046 0.0217 0.0217
Echinococcus multilocularis acetylcholinesterase 0.0376 0.2698 0.2698
Schistosoma mansoni acetylcholinesterase 0.0064 0.0346 0.0346
Loa Loa (eye worm) hypothetical protein 0.0042 0.0184 0.0667
Echinococcus multilocularis neutral alpha glucosidase AB 0.0037 0.0149 0.0149
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0046 0.0217 0.0217
Onchocerca volvulus 0.003 0.0094 0.0176
Brugia malayi Glycosyl hydrolases family 31 protein 0.0169 0.1136 0.4193
Schistosoma mansoni hypothetical protein 0.0035 0.0131 0.0131
Mycobacterium ulcerans lipase LipD 0.0035 0.0134 0.1826
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0566 0.0566
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.0239 0.0868
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0131 0.0131
Loa Loa (eye worm) hypothetical protein 0.0127 0.0821 0.3031
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0149 0.2035
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0076 0.0076
Echinococcus granulosus zinc finger protein 0.002 0.002 0.002
Loa Loa (eye worm) TAR-binding protein 0.0125 0.0811 0.2993
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.0239 0.0239
Loa Loa (eye worm) transcription factor SMAD2 0.0118 0.0753 0.2776
Echinococcus multilocularis mitogen activated protein kinase 3 0.0049 0.0238 0.0238
Brugia malayi follicle stimulating hormone receptor 0.0231 0.1602 0.5927
Loa Loa (eye worm) hypothetical protein 0.0376 0.2698 1
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0037 0.2315
Loa Loa (eye worm) MH2 domain-containing protein 0.0118 0.0753 0.2776
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0049 0.0238 0.3319
Echinococcus granulosus alkaline phosphatase 0.0491 0.3561 0.3561
Schistosoma mansoni lamin 0.0027 0.0067 0.0067
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0064 0.0346 0.0346
Echinococcus multilocularis neuropeptide receptor A26 0.0457 0.3308 0.3308
Brugia malayi bHLH-PAS transcription factor 0.0035 0.0134 0.0469
Schistosoma mansoni bromodomain containing protein 0.0065 0.036 0.036
Loa Loa (eye worm) hypothetical protein 0.015 0.0998 0.3686
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0064 0.0346 0.0346
Schistosoma mansoni caspase-7 (C14 family) 0.003 0.0094 0.0094
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0147 0.0147
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0134 0.0807
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0134 0.0134
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0566 0.0566
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.0239 0.0239
Trichomonas vaginalis esterase, putative 0.0035 0.0134 0.0799
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.0239 0.0239
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.0566 0.2082
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0125 0.0811 0.2993
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0149 0.0891
Onchocerca volvulus 0.0064 0.0346 0.1829
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0111 0.07 0.4376
Loa Loa (eye worm) beta-lactamase 0.0035 0.0134 0.0481
Echinococcus multilocularis carboxylesterase 5A 0.0376 0.2698 0.2698
Brugia malayi Carboxylesterase family protein 0.0064 0.0346 0.1255
Mycobacterium tuberculosis Conserved protein 0.0035 0.0134 0.0807
Echinococcus granulosus tar DNA binding protein 0.0125 0.0811 0.0811
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0111 0.07 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0084 0.0084
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0198 0.1359 0.1359
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0064 0.0346 0.2136
Loa Loa (eye worm) hypothetical protein 0.0044 0.0199 0.0722
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0111 0.07 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0169 0.1136 0.1136
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0134 0.0799
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0134 0.0807
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0134 0.0799
Brugia malayi beta-lactamase 0.0035 0.0134 0.0469
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0134 0.1826
Loa Loa (eye worm) MBCTL1 0.0056 0.029 0.1059
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0023 0.0037 0.0423
Echinococcus multilocularis alkaline phosphatase, intestinal, gene 2 0.0491 0.3561 0.3561
Leishmania major hypothetical protein, conserved 0.0035 0.0134 0.1826
Echinococcus multilocularis para nitrobenzyl esterase 0.0064 0.0346 0.0346
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0149 0.2035
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0043 0.0043
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0134 0.1826
Schistosoma mansoni tar DNA-binding protein 0.0125 0.0811 0.0811
Echinococcus granulosus L aminoadipate semialdehyde 0.008 0.0471 0.0471
Schistosoma mansoni hypothetical protein 0.0304 0.2154 0.2154
Echinococcus multilocularis lamin dm0 0.0027 0.0067 0.0067
Leishmania major alpha glucosidase II subunit, putative 0.0037 0.0149 0.2035
Schistosoma mansoni alkaline phosphatase 0.0491 0.3561 0.3561
Schistosoma mansoni inositol monophosphatase 0.0111 0.07 0.07
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0134 0.0807
Echinococcus granulosus neuropeptide s receptor 0.0457 0.3308 0.3308
Onchocerca volvulus 0.0229 0.1589 1
Mycobacterium leprae Probable lipase LipE 0.0035 0.0134 0.1687
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0111 0.07 1
Echinococcus multilocularis lamin 0.0027 0.0067 0.0067
Schistosoma mansoni serine/threonine protein kinase 0.0049 0.0238 0.0238
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0049 0.0238 0.3319
Schistosoma mansoni alpha-glucosidase 0.0145 0.0959 0.0959
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0008 0.0008
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0134 1
Echinococcus granulosus apoptotic protease activating factor 1 0.003 0.0094 0.0094
Mycobacterium tuberculosis Conserved protein 0.0035 0.0134 0.0807
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0134 0.0469
Echinococcus granulosus lamin dm0 0.0027 0.0067 0.0067
Brugia malayi Cell death protein 3 precursor 0.003 0.0094 0.032
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0231 0.1602 0.5932
Onchocerca volvulus 0.0098 0.0601 0.3508
Schistosoma mansoni ap endonuclease 0.0019 0.0008 0.0008
Schistosoma mansoni tar DNA-binding protein 0.0125 0.0811 0.0811
Schistosoma mansoni tar DNA-binding protein 0.0125 0.0811 0.0811
Loa Loa (eye worm) hypothetical protein 0.0161 0.1078 0.3983
Brugia malayi hypothetical protein 0.0035 0.0131 0.0458
Schistosoma mansoni inositol monophosphatase 0.0111 0.07 0.07
Echinococcus multilocularis zinc finger protein 0.002 0.002 0.002
Trichomonas vaginalis inositol monophosphatase, putative 0.0111 0.07 0.4376
Loa Loa (eye worm) inositol-1 0.0111 0.07 0.258
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0049 0.0238 0.3319
Loa Loa (eye worm) carboxylesterase 0.0376 0.2698 1
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0023 0.0037 0.0423
Echinococcus granulosus neuroligin 0.0064 0.0346 0.0346
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.1782
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0049 0.0238 0.3319
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.0239 0.0239
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.1782
Schistosoma mansoni intermediate filament proteins 0.0027 0.0067 0.0067
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0149 0.0891
Schistosoma mansoni hypothetical protein 0.003 0.0094 0.0094
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0134 0.0134
Trichomonas vaginalis set domain proteins, putative 0.0229 0.1589 1
Loa Loa (eye worm) RNA binding protein 0.0125 0.0811 0.2993
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0238 0.1453
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0111 0.07 0.4376
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0037 1
Echinococcus multilocularis neuropeptide s receptor 0.0457 0.3308 0.3308
Loa Loa (eye worm) hypoxia-induced factor 1 0.0148 0.0984 0.3635
Onchocerca volvulus 0.0064 0.0346 0.1829
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.0149 0.0891
Loa Loa (eye worm) carboxylesterase 0.0064 0.0346 0.1265
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0008 0.0008
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0043 0.0043
Mycobacterium ulcerans hypothetical protein 0.0035 0.0134 0.1826
Echinococcus multilocularis caspase 2 0.003 0.0094 0.0094
Onchocerca volvulus 0.0035 0.0134 0.044
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0134 0.0807
Echinococcus multilocularis BC026374 protein (S09 family) 0.0064 0.0346 0.0346
Entamoeba histolytica hypothetical protein 0.0035 0.0131 0.1782
Mycobacterium ulcerans putative regulatory protein 0.0035 0.0134 0.1826
Onchocerca volvulus 0.0029 0.0084 0.0111
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Echinococcus granulosus mitogen activated protein kinase 3 0.0049 0.0238 0.0238
Loa Loa (eye worm) hypothetical protein 0.0046 0.0217 0.0788
Loa Loa (eye worm) acetylcholinesterase 1 0.0376 0.2698 1
Echinococcus multilocularis musashi 0.0027 0.0067 0.0067
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0043 0.0043
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Brugia malayi Pre-SET motif family protein 0.0201 0.138 0.5099
Echinococcus multilocularis histone acetyltransferase MYST2 0.0056 0.029 0.029
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0111 0.07 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0149 0.0891
Echinococcus granulosus mitogen activated protein kinase 0.0049 0.0238 0.0238
Brugia malayi Carboxylesterase family protein 0.0064 0.0346 0.1255
Brugia malayi PHD-finger family protein 0.0026 0.0061 0.0198
Loa Loa (eye worm) hypothetical protein 0.003 0.0094 0.0331
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0149 0.0891
Loa Loa (eye worm) hypothetical protein 0.003 0.0094 0.0331
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0023 0.0037 0.5
Onchocerca volvulus Huntingtin homolog 0.0127 0.0821 0.4955
Echinococcus multilocularis neuroligin 0.0064 0.0346 0.0346
Onchocerca volvulus 0.0035 0.0134 0.044
Onchocerca volvulus Cell death protein 3 homolog 0.003 0.0094 0.0176
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0134 0.1826
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0134 0.0481
Echinococcus multilocularis microtubule associated protein 2 0.1347 1 1
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0067 0.022
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0566 0.0566
Echinococcus granulosus carboxylesterase 5A 0.0376 0.2698 0.2698
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0134 0.0807
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0056 0.029 0.029
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.0239 0.0239
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0131 0.0131
Echinococcus multilocularis tar DNA binding protein 0.0125 0.0811 0.0811
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0049 0.0238 0.3319
Schistosoma mansoni gliotactin 0.0064 0.0346 0.0346
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0111 0.07 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0134 0.0481
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0046 0.0217 0.0217
Plasmodium vivax SET domain protein, putative 0.0029 0.0084 0.6037
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.008 0.0471 0.1723
Loa Loa (eye worm) hypothetical protein 0.0064 0.0346 0.1265
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.1136 0.1136
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0049 0.0238 0.3319
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0134 0.0799
Leishmania major phosphopantetheinyl transferase-like protein 0.0023 0.0037 0.0423
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0376 0.2698 0.2698
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.0149 0.0534
Brugia malayi hypothetical protein 0.0127 0.0821 0.3023
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0238 0.1453
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0149 0.2035
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0023 0.0037 0.0423
Brugia malayi intermediate filament protein 0.0027 0.0067 0.022

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) 0 % Tested for in vivo inhibition of galactitol accumulation in the lens of galactose-fed rats;ND=Not determined ChEMBL. 8027987
Inhibition (functional) 0 % Tested for in vivo inhibition of galactitol accumulation in the sciatic nerve of galactose-fed rats;ND=Not determined ChEMBL. 8027987
Inhibition (binding) = 47 % Inhibition of aldose reductase activity in partially purified bovine lens preparation at 10 e-6 M ChEMBL. 8027987
Inhibition (binding) = 47 % Inhibition of aldose reductase activity in partially purified bovine lens preparation at 10 e-6 M ChEMBL. 8027987

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

1 literature reference was collected for this gene.

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