Detailed information for compound 1392955

Basic information

Technical information
  • TDR Targets ID: 1392955
  • Name: (2E)-2-cyano-2-[5-ethyl-3-(4-fluorophenyl)-4- oxo-1,3-thiazolidin-2-ylidene]acetamide
  • MW: 305.327 | Formula: C14H12FN3O2S
  • H donors: 1 H acceptors: 3 LogP: 1.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC1S/C(=C(/C(=O)N)\C#N)/N(C1=O)c1ccc(cc1)F
  • InChi: 1S/C14H12FN3O2S/c1-2-11-13(20)18(9-5-3-8(15)4-6-9)14(21-11)10(7-16)12(17)19/h3-6,11H,2H2,1H3,(H2,17,19)/b14-10+
  • InChiKey: PNGUYBLNBKYBDN-GXDHUFHOSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2E)-2-cyano-2-[5-ethyl-3-(4-fluorophenyl)-4-oxo-thiazolidin-2-ylidene]acetamide
  • (2E)-2-cyano-2-[5-ethyl-3-(4-fluorophenyl)-4-oxo-2-thiazolidinylidene]acetamide
  • (2E)-2-cyano-2-[5-ethyl-3-(4-fluorophenyl)-4-keto-thiazolidin-2-ylidene]acetamide
  • (2E)-2-cyano-2-[5-ethyl-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]ethanamide
  • MLS000041598
  • SMR000046612

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
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0199 0.0716 0.0709
Echinococcus multilocularis tar DNA binding protein 0.0063 0.0144 0.0136
Echinococcus granulosus lysosomal alpha mannosidase 0.0127 0.0414 0.0406
Onchocerca volvulus 0.0047 0.0078 0.0148
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0063 0.0144 0.0182
Plasmodium falciparum plasmepsin VIII, putative 0.0047 0.0078 0.0989
Schistosoma mansoni ceramide glucosyltransferase 0.0498 0.1976 0.2496
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0199 0.0716 0.0907
Loa Loa (eye worm) hypothetical protein 0.0831 0.3377 0.4278
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0199 0.0716 0.0709
Loa Loa (eye worm) hypothetical protein 0.0095 0.0281 0.0356
Brugia malayi Glycosyl hydrolases family 31 protein 0.0388 0.1511 0.1915
Brugia malayi vesicular acetylcholine transporter unc-17 0.0218 0.0797 0.1009
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0123 0.0398 0.039
Schistosoma mansoni beta-mannosidase 0.0104 0.032 0.0395
Mycobacterium ulcerans alpha-L-fucosidase 0.2406 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0192 0.0688 0.1436
Loa Loa (eye worm) hypothetical protein 0.0032 0.0017 0.0021
Schistosoma mansoni ceramide glucosyltransferase 0.0498 0.1976 0.2496
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0197 0.0711 0.9928
Echinococcus granulosus endoplasmic reticulum mannosyl oligosaccharide 0.0095 0.0281 0.0273
Schistosoma mansoni thyroid hormone receptor 0.0133 0.044 0.0547
Brugia malayi Glycosyl hydrolases family 31 protein 0.1638 0.6769 0.8576
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0144 0.0172
Plasmodium falciparum plasmepsin X 0.0047 0.0078 0.0989
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Loa Loa (eye worm) hypothetical protein 0.003 0.0008 0.001
Brugia malayi RNA recognition motif domain containing protein 0.0063 0.0144 0.0182
Plasmodium vivax plasmepsin V, putative 0.0047 0.0078 0.0989
Brugia malayi Platelet-activating factor acetylhydrolase, plasma/intracellular isoform II family protein 0.0323 0.1241 0.1572
Brugia malayi Pre-SET motif family protein 0.0031 0.001 0.0012
Trichomonas vaginalis alpha-glucosidase, putative 0.0388 0.1511 0.239
Schistosoma mansoni jumonji domain containing protein 0.0079 0.0213 0.0259
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Onchocerca volvulus 0.0323 0.1241 0.2604
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0127 0.0414 0.0515
Echinococcus multilocularis serotonin receptor 0.0059 0.0131 0.0123
Brugia malayi Ceramide glucosyltransferase 0.0498 0.1976 0.2504
Loa Loa (eye worm) CXXC zinc finger family protein 0.0057 0.012 0.0151
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0047 0.0078 0.0099
Loa Loa (eye worm) glycosyl hydrolase family 38 protein 0.0142 0.0478 0.0605
Trichomonas vaginalis alpha-glucosidase, putative 0.0192 0.0688 0.1073
Plasmodium vivax hypothetical protein, conserved 0.0197 0.0711 0.9928
Loa Loa (eye worm) hypothetical protein 0.0646 0.2598 0.3292
Brugia malayi Pre-SET motif family protein 0.0206 0.0748 0.0948
Echinococcus multilocularis beta galactosidase 0.0646 0.2598 0.2592
Trichomonas vaginalis conserved hypothetical protein 0.0322 0.1234 0.1946
Trichomonas vaginalis glycoside hydrolase, putative 0.0514 0.2042 0.3239
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0179 0.0634 0.0626
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0035 0.0027
Brugia malayi RNA binding protein 0.0063 0.0144 0.0182
Trichomonas vaginalis glucosylceramidase, putative 0.105 0.4297 0.6847
Schistosoma mansoni cathepsin D (A01 family) 0.0586 0.2344 0.2963
Loa Loa (eye worm) hypothetical protein 0.0082 0.0226 0.0286
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0099 0.0298 0.029
Schistosoma mansoni thyroid hormone receptor 0.0133 0.044 0.0547
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0206 0.0748 0.0947
Schistosoma mansoni cpg binding protein 0.0057 0.012 0.0141
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Onchocerca volvulus Phospholipase A2 homolog 0.0515 0.2045 0.4303
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Loa Loa (eye worm) RNA binding protein 0.0063 0.0144 0.0182
Giardia lamblia Ceramide glucosyltransferase 0.0226 0.0831 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.003 0.0022
Brugia malayi jmjC domain containing protein 0.0099 0.0298 0.0378
Entamoeba histolytica alpha-1,2-mannosidase, putative 0.0858 0.3488 1
Trypanosoma cruzi lanosterol synthase, putative 0.036 0.1395 0.8941
Loa Loa (eye worm) jmjC domain-containing protein 0.004 0.0049 0.0061
Echinococcus granulosus dnaJ subfamily B 0.0404 0.158 0.1573
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0218 0.0797 0.1666
Schistosoma mansoni bile acid beta-glucosidase-related 0.0206 0.0746 0.0935
Brugia malayi Melibiase family protein 0.0146 0.0493 0.0625
Plasmodium falciparum plasmepsin IV 0.0199 0.0716 1
Brugia malayi Glycosyl hydrolases family 38 protein 0.009 0.026 0.0329
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.001 0.0002
Trypanosoma brucei glycosyl hydrolase-like protein 0.0192 0.0688 0.3203
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Echinococcus multilocularis fucosidase, alpha L 1, tissue 0.2406 1 1
Entamoeba histolytica beta-galactosidase, putative 0.0217 0.0795 0.2213
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.1519 0.6268 0.7942
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0836 0.3395 0.5404
Trichomonas vaginalis beta-mannosidase, putative 0.0104 0.032 0.0483
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.003 0.0027
Schistosoma mansoni vesicular acetylcholine transporter 0.0218 0.0797 0.1
Echinococcus multilocularis lysosomal alpha mannosidase 0.0127 0.0414 0.0406
Brugia malayi PHD-finger family protein 0.003 0.0008 0.001
Schistosoma mansoni hypothetical protein 0.0035 0.003 0.0027
Trichomonas vaginalis alpha-glucosidase, putative 0.0388 0.1511 0.239
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0085 0.0236 0.035
Brugia malayi jmjC domain containing protein 0.004 0.0049 0.0062
Trichomonas vaginalis beta-glucosidase, putative 0.0129 0.0421 0.0646
Schistosoma mansoni cathepsin D (A01 family) 0.0586 0.2344 0.2963
Plasmodium vivax aspartyl proteinase, putative 0.0047 0.0078 0.0989
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0047 0.0078 0.0466
Loa Loa (eye worm) hypothetical protein 0.0179 0.0634 0.0802
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Echinococcus multilocularis non lysosomal glucosylceramidase 0.0206 0.0746 0.0738
Plasmodium falciparum plasmepsin VI 0.0199 0.0716 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0078 0.0099
Trypanosoma cruzi phospholipase A1, putative 0.0323 0.1241 0.7536
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.0144 0.0182
Brugia malayi Phospholipase A2 family protein 0.0179 0.0634 0.0803
Trichomonas vaginalis beta-galactosidase, putative 0.0322 0.1234 0.1946
Leishmania major lanosterol synthase, putative 0.034 0.1309 0.7547
Trichomonas vaginalis sucrase-isomaltase, putative 0.0357 0.1384 0.2186
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0836 0.3395 0.5404
Echinococcus granulosus lysosomal alpha glucosidase 0.1638 0.6769 0.6766
Brugia malayi Pepsin A precursor 0.0047 0.0078 0.0099
Echinococcus multilocularis serotonin receptor 0.0059 0.0131 0.0123
Brugia malayi hypothetical protein 0.0047 0.0078 0.0099
Trichomonas vaginalis glucosylceramidase, putative 0.105 0.4297 0.6847
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.001 0.0002
Schistosoma mansoni memapsin-2 (A01 family) 0.0047 0.0078 0.0089
Brugia malayi lysosomal alpha-mannosidase 0.009 0.026 0.0329
Loa Loa (eye worm) ceramide glucosyltransferase 0.0498 0.1976 0.2503
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0192 0.0688 0.1904
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.001 0.0002
Schistosoma mansoni biogenic amine (5HT) receptor 0.0059 0.0131 0.0155
Plasmodium falciparum plasmepsin III 0.0047 0.0078 0.0989
Loa Loa (eye worm) glycosyl hydrolase family 2 0.0113 0.0356 0.0451
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0142 0.0478 0.0737
Loa Loa (eye worm) hypothetical protein 0.009 0.026 0.0328
Schistosoma mansoni cpg binding protein 0.006 0.0133 0.0159
Trypanosoma cruzi lanosterol synthase, putative 0.036 0.1395 0.8941
Echinococcus granulosus neutral alpha glucosidase AB 0.0388 0.1511 0.1504
Loa Loa (eye worm) hypothetical protein 0.0032 0.0017 0.0021
Loa Loa (eye worm) beta-glucuronidase 0.0104 0.032 0.0404
Brugia malayi Mannosyl-oligosaccharide alpha-1,2-mannosidase isoform 1 0.0095 0.0281 0.0356
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0179 0.0634 0.0626
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.1638 0.6769 0.8576
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Brugia malayi CXXC zinc finger family protein 0.0057 0.012 0.0152
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Loa Loa (eye worm) hypothetical protein 0.0095 0.0281 0.0356
Toxoplasma gondii aspartyl protease ASP1 0.0199 0.0716 0.471
Brugia malayi Bromodomain containing protein 0.003 0.0008 0.001
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0199 0.0716 0.1118
Trichomonas vaginalis alpha-glucosidase, putative 0.0192 0.0688 0.1073
Loa Loa (eye worm) hypothetical protein 0.0059 0.0131 0.0165
Echinococcus granulosus lysine specific demethylase 5A 0.004 0.0049 0.004
Toxoplasma gondii aspartyl protease ASP3 0.0047 0.0078 0.0466
Schistosoma mansoni bile acid beta-glucosidase-related 0.0206 0.0746 0.0935
Loa Loa (eye worm) hypothetical protein 0.0059 0.0131 0.0165
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0049 0.0051
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Echinococcus granulosus beta galactosidase 0.0646 0.2598 0.2592
Toxoplasma gondii melibiase subfamily protein 0.0179 0.0634 0.4161
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0148 0.0505 0.0824
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.003 0.0022
Leishmania major phospholipase A1, putative 0.0323 0.1241 0.6715
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0388 0.1511 1
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0192 0.0688 0.2498
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0179 0.0634 0.0793
Plasmodium vivax aspartyl proteinase, putative 0.0199 0.0716 1
Echinococcus granulosus ceramide glucosyltransferase 0.0498 0.1976 0.197
Plasmodium falciparum plasmepsin VII 0.0047 0.0078 0.0989
Loa Loa (eye worm) TAR-binding protein 0.0063 0.0144 0.0182
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0099 0.0298 0.029
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Plasmodium falciparum plasmepsin V 0.0047 0.0078 0.0989
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Plasmodium falciparum plasmepsin I 0.0199 0.0716 1
Onchocerca volvulus Glucosylceramidase homolog 0.0997 0.4072 0.8584
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0199 0.0716 0.0898
Echinococcus multilocularis vesicular acetylcholine transporter 0.0218 0.0797 0.0789
Schistosoma mansoni cpg binding protein 0.006 0.0133 0.0159
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.001 0.0009
Echinococcus multilocularis mannosyl oligosaccharide 1,2 alpha mannosidase 0.0095 0.0281 0.0273
Trichomonas vaginalis maltase-glucoamylase, putative 0.0388 0.1511 0.239
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0095 0.0281 0.0422
Brugia malayi Glycosyl hydrolases family 2, sugar binding domain containing protein 0.0113 0.0356 0.0451
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0144 0.0172
Trypanosoma brucei glucosidase, putative 0.0388 0.1511 1
Schistosoma mansoni hypothetical protein 0.0404 0.158 0.1994
Mycobacterium tuberculosis Possible conserved exported protein 0.0858 0.3488 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0388 0.1511 0.239
Schistosoma mansoni alpha glucosidase 0.0388 0.1511 0.1907
Schistosoma mansoni hypothetical protein 0.0123 0.0398 0.0495
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0049 0.0051
Echinococcus multilocularis lysosomal alpha glucosidase 0.1638 0.6769 0.6766
Echinococcus granulosus tar DNA binding protein 0.0063 0.0144 0.0136
Trichomonas vaginalis maltase-glucoamylase, putative 0.0192 0.0688 0.1073
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0192 0.0688 0.1073
Onchocerca volvulus 0.0057 0.012 0.0236
Echinococcus multilocularis jumonji domain containing protein 0.0042 0.0058 0.005
Onchocerca volvulus 0.0047 0.0078 0.0148
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0144 0.0172
Loa Loa (eye worm) hypothetical protein 0.0139 0.0465 0.0588
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0146 0.0493 0.0615
Echinococcus granulosus cpg binding protein 0.006 0.0133 0.0125
Schistosoma mansoni mannosyl-oligosaccharide alpha-12-mannosidase 0.0095 0.0281 0.0346
Echinococcus multilocularis endoplasmic reticulum mannosyl oligosaccharide 0.0095 0.0281 0.0273
Brugia malayi aspartic protease BmAsp-2, identical 0.0047 0.0078 0.0099
Loa Loa (eye worm) hypothetical protein 0.009 0.026 0.0328
Echinococcus multilocularis cpg binding protein 0.006 0.0133 0.0125
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0199 0.0716 0.471
Brugia malayi Glycosyl hydrolases family 38 protein 0.0142 0.0478 0.0606
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0146 0.0493 0.0615
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0146 0.0493 0.0761
Onchocerca volvulus 0.0323 0.1241 0.2604
Plasmodium vivax SET domain protein, putative 0.0031 0.001 0.002
Brugia malayi hypothetical protein 0.0035 0.003 0.0038
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0357 0.1384 0.3916
Brugia malayi aspartic protease BmAsp-1, identical 0.0047 0.0078 0.0099
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0218 0.0797 0.1009
Plasmodium vivax plasmepsin IV, putative 0.0199 0.0716 1
Echinococcus multilocularis bile acid beta glucosidase 0.0206 0.0746 0.0738
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0144 0.0172
Schistosoma mansoni tar DNA-binding protein 0.0063 0.0144 0.0172
Brugia malayi manba-prov protein 0.0104 0.032 0.0405
Loa Loa (eye worm) alpha-L-fucosidase 0.1905 0.7892 1
Trichomonas vaginalis conserved hypothetical protein 0.0095 0.0281 0.0422
Plasmodium vivax aspartyl protease, putative 0.0047 0.0078 0.0989
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0122 0.0392 0.0487
Echinococcus granulosus alpha mannosidase 2 0.0032 0.0017 0.0009
Onchocerca volvulus 0.0323 0.1241 0.2604
Echinococcus multilocularis alpha mannosidase 2 0.009 0.026 0.0251
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0179 0.0634 0.0793
Brugia malayi Glycosyl hydrolases family 31 protein 0.0192 0.0688 0.0872
Toxoplasma gondii histone lysine methyltransferase SET1 0.0109 0.0338 0.2194
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.1519 0.6268 0.7942
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0179 0.0634 0.0793
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.001 0.0001
Echinococcus multilocularis ceramide glucosyltransferase 0.0498 0.1976 0.197
Echinococcus multilocularis thyroid hormone receptor alpha 0.0133 0.044 0.0432
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.009 0.026 0.0319
Leishmania major alpha glucosidase II subunit, putative 0.0388 0.1511 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0192 0.0688 0.1073
Echinococcus granulosus mannosyl oligosaccharide 12 alpha mannosidase 0.0095 0.0281 0.0273
Trichomonas vaginalis alpha-glucosidase, putative 0.0388 0.1511 0.239
Echinococcus granulosus jumonji domain containing protein 0.0042 0.0058 0.005
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Echinococcus multilocularis neutral alpha glucosidase AB 0.0388 0.1511 0.1504
Echinococcus granulosus vesicular acetylcholine transporter 0.0218 0.0797 0.0789
Onchocerca volvulus 0.0031 0.001 0.0003
Onchocerca volvulus 0.009 0.026 0.0531
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0179 0.0634 0.0626
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0388 0.1511 0.239
Trypanosoma cruzi hypothetical protein, conserved 0.0388 0.1511 1
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Trypanosoma brucei lysosomal alpha-mannosidase precursor, putative 0.0127 0.0414 0.0939
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.001 0.0001
Plasmodium falciparum plasmepsin II 0.0199 0.0716 1
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Plasmodium vivax aspartyl protease, putative 0.0047 0.0078 0.0989
Trichomonas vaginalis set domain proteins, putative 0.0235 0.0867 0.136
Trichomonas vaginalis alpha-glucosidase, putative 0.0192 0.0688 0.1073
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0123 0.0398 0.039
Schistosoma mansoni hypothetical protein 0.0305 0.1164 0.1466
Trichomonas vaginalis alpha-glucosidase, putative 0.0192 0.0688 0.1073
Echinococcus multilocularis transfer RNA-Trp 0.0095 0.0281 0.0273
Trypanosoma brucei phospholipase A1, putative 0.0323 0.1241 0.7767
Trypanosoma cruzi hypothetical protein, conserved 0.0388 0.1511 1
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Trichomonas vaginalis alpha-mannosidase, putative 0.0142 0.0478 0.0737
Brugia malayi Eukaryotic aspartyl protease family protein 0.0047 0.0078 0.0099
Schistosoma mansoni alpha-glucosidase 0.1473 0.6073 0.7693
Echinococcus multilocularis dnaJ subfamily B 0.0404 0.158 0.1573
Trichomonas vaginalis alpha-glucosidase, putative 0.0192 0.0688 0.1073
Loa Loa (eye worm) hypothetical protein 0.0058 0.0123 0.0155
Schistosoma mansoni alpha-glucosidase 0.1473 0.6073 0.7693
Loa Loa (eye worm) PHD-finger family protein 0.003 0.0008 0.001
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0192 0.0688 0.2498
Brugia malayi Glycosyl hydrolases family 38 protein 0.009 0.026 0.0329
Onchocerca volvulus 0.009 0.026 0.0531
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0179 0.0634 0.0793
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Loa Loa (eye worm) hypothetical protein 0.0199 0.0716 0.0907
Loa Loa (eye worm) hypothetical protein 0.0192 0.0688 0.0871
Toxoplasma gondii aspartyl protease 0.0047 0.0078 0.0466
Echinococcus multilocularis lysosomal alpha glucosidase 0.1638 0.6769 0.6766
Trichomonas vaginalis alpha-glucosidase, putative 0.0388 0.1511 0.239
Loa Loa (eye worm) hypothetical protein 0.0094 0.0277 0.0351
Trypanosoma cruzi phospholipase A2-like protein, putative 0.0148 0.0505 0.0824
Trypanosoma brucei lanosterol synthase 0.036 0.1395 0.9041
Brugia malayi hypothetical protein 0.0047 0.0078 0.0099
Loa Loa (eye worm) platelet-activating factor acetylhydrolase 0.0323 0.1241 0.1572
Loa Loa (eye worm) aspartyl protease 6 0.0047 0.0078 0.0099
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.001 0.0002
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Plasmodium vivax aspartyl protease, putative 0.0047 0.0078 0.0989
Loa Loa (eye worm) hypothetical protein 0.0047 0.0078 0.0099
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Onchocerca volvulus 0.0235 0.0867 0.1815
Loa Loa (eye worm) hypothetical protein 0.0515 0.2045 0.2591
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0388 0.1511 0.1914
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0388 0.1511 0.4285
Echinococcus granulosus biogenic amine 5HT receptor 0.0059 0.0131 0.0123
Loa Loa (eye worm) hypothetical protein 0.0032 0.0017 0.0021
Onchocerca volvulus 0.1156 0.4742 1
Loa Loa (eye worm) hypothetical protein 0.0052 0.0099 0.0125
Brugia malayi TAR-binding protein 0.0063 0.0144 0.0182
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0079 0.0213 0.0313
Trichomonas vaginalis glucosylceramidase, putative 0.1519 0.6268 1
Trypanosoma cruzi phospholipase A1, putative 0.0323 0.1241 0.7536
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0047 0.0078 0.0089
Schistosoma mansoni alpha-l-fucosidase 0.1905 0.7892 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.001 0.0001
Trichomonas vaginalis glycoside hydrolases, putative 0.0129 0.0421 0.0646
Echinococcus granulosus bile acid beta glucosidase 0.0206 0.0746 0.0738
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0058 0.0123 0.0145
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0095 0.0281 0.0422
Trichomonas vaginalis glucosylceramidase, putative 0.0997 0.4072 0.6486
Plasmodium falciparum plasmepsin IX 0.0047 0.0078 0.0989
Brugia malayi Cytochrome P450 family protein 0.0028 0.0001 0.0001
Echinococcus granulosus non lysosomal glucosylceramidase 0.0206 0.0746 0.0738
Trichomonas vaginalis alpha-glucosidase, putative 0.0388 0.1511 0.239
Brugia malayi Beta-glucuronidase precursor 0.0104 0.032 0.0405
Schistosoma mansoni mannosidase alpha class 2a 0.009 0.026 0.0319
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.0498 0.1976 0.4157
Loa Loa (eye worm) hypothetical protein 0.0031 0.001 0.0012
Brugia malayi Alpha-L-fucosidase family protein 0.1905 0.7892 1
Onchocerca volvulus Phospholipase A2 homolog 0.0179 0.0634 0.1321
Loa Loa (eye worm) hypothetical protein 0.0146 0.0493 0.0624
Loa Loa (eye worm) mannosidase 0.0095 0.0281 0.0356
Schistosoma mansoni beta-galactosidase 0.0646 0.2598 0.3285

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 32.61 um PUBCHEM_BIOASSAY: Dose response biochemical screening assay for inhibitors of c-Jun N-Terminal Kinase 3 (JNK3). (Class of assay: confirmatory) [Related pubchem assays: 746 ] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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