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

Hover on a compound node to display the structore

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

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.
 
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

No literature references available for this target.

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