Detailed information for compound 66543

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 347.387 | Formula: C13H21N3O6S
  • H donors: 4 H acceptors: 5 LogP: -3.57 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSCC[C@@H](C(=O)O)NC(=O)[C@@H](CNC(=O)/C=C/C(=O)OC)N
  • InChi: 1S/C13H21N3O6S/c1-22-11(18)4-3-10(17)15-7-8(14)12(19)16-9(13(20)21)5-6-23-2/h3-4,8-9H,5-7,14H2,1-2H3,(H,15,17)(H,16,19)(H,20,21)/b4-3+/t8-,9+/m1/s1
  • InChiKey: ZXSPAFZIRPOCRZ-BKIAHZASSA-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
Trypanosoma cruzi DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0028 0.049 0.0476
Onchocerca volvulus Bile acid receptor homolog 0.0028 0.049 0.1668
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Trichomonas vaginalis glutaminase, putative 0.0296 0.9906 0.9905
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0028 0.049 0.0495
Trypanosoma cruzi phytoene synthase, putative 0.0085 0.2468 0.2695
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0028 0.049 0.0476
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0094 0.0138
Echinococcus granulosus ecdysone induced protein 78C 0.0028 0.049 0.0867
Echinococcus granulosus FTZ F1 alpha 0.0028 0.049 0.0867
Treponema pallidum fructose-bisphosphate aldolase 0.0299 1 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0019
Schistosoma mansoni intermediate filament proteins 0.0027 0.044 0.0426
Schistosoma mansoni hypothetical protein 0.0016 0.0047 0.0028
Schistosoma mansoni hypothetical protein 0.0034 0.069 0.0679
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0019
Plasmodium falciparum fructose-bisphosphate aldolase 0.0098 0.2953 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0028 0.049 0.0867
Echinococcus multilocularis dna polymerase kappa 0.0044 0.1056 0.1909
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0046 0.1116 0.3574
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.0295 0.0279
Trypanosoma cruzi cysteine peptidase, putative 0.0017 0.0094 0.0056
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0015 0.0019 0.0019
Entamoeba histolytica cysteine protease, putative 0.0017 0.0094 0.0051
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0028 0.049 0.0476
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0016 0.0043 0.0044
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0028 0.049 0.1668
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Loa Loa (eye worm) acetyltransferase 0.0157 0.5013 0.5061
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0028 0.049 0.0867
Trypanosoma brucei DNA polymerase IV, putative 0.0044 0.1056 0.1126
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0028 0.049 0.0495
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Onchocerca volvulus 0.0028 0.049 0.1668
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0094 0.0076
Toxoplasma gondii fructose-1,6-bisphosphate aldolase 0.0098 0.2953 1
Onchocerca volvulus 0.0027 0.044 0.1459
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0047 0.005
Leishmania major cathepsin L-like protease 0.0065 0.1786 0.1937
Echinococcus multilocularis lamin dm0 0.0027 0.044 0.0775
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Echinococcus granulosus jun protein 0.0091 0.2691 0.4919
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Mycobacterium ulcerans glutaminase 0.0296 0.9906 1
Giardia lamblia Fructose-bisphosphate aldolase 0.0299 1 1
Leishmania major cathepsin L-like protease 0.0017 0.0094 0.0056
Trichomonas vaginalis bromodomain-containing protein, putative 0.0046 0.1116 0.1031
Trypanosoma brucei fructose-bisphosphate aldolase, glycosomal, putative 0.0098 0.2953 0.3234
Loa Loa (eye worm) hypothetical protein 0.0016 0.0047 0.0047
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0028 0.049 0.0867
Leishmania major cathepsin L-like protease 0.0065 0.1786 0.1937
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0028 0.049 0.0476
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Mycobacterium leprae Possible D-ribose-binding protein 0.0263 0.8729 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0094 0.0138
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0046 0.1116 0.1031
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.006 0.1587 0.1715
Schistosoma mansoni hypothetical protein 0.0039 0.0863 0.0853
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0028 0.049 0.0867
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0028 0.049 0.0495
Onchocerca volvulus 0.0027 0.044 0.1459
Brugia malayi hypothetical protein 0.0039 0.0863 0.0871
Brugia malayi ecdysteroid receptor 0.0028 0.049 0.0495
Schistosoma mansoni coup transcription factor 0.0028 0.049 0.0476
Brugia malayi photoreceptor-specific nuclear receptor 0.0028 0.049 0.0495
Loa Loa (eye worm) hypothetical protein 0.0034 0.0676 0.0683
Schistosoma mansoni hypothetical protein 0.0169 0.5451 0.5494
Brugia malayi Nuclear hormone receptor-like 1 0.0028 0.049 0.0495
Brugia malayi glutaminase DH11.1 0.0296 0.9906 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0019
Brugia malayi bZIP transcription factor family protein 0.0091 0.2691 0.2717
Trypanosoma brucei DNA polymerase kappa, putative 0.0034 0.0676 0.0703
Toxoplasma gondii fructose-1,6-bisphosphate aldolase 0.0098 0.2953 1
Brugia malayi steroid hormone receptor 0.0028 0.049 0.0495
Brugia malayi polk-prov protein 0.0034 0.0676 0.0683
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0299 1 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0042 0.098 0.0941
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0028 0.049 0.0495
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0028 0.049 0.0495
Loa Loa (eye worm) fibroinase 0.0017 0.0094 0.0095
Schistosoma mansoni hypothetical protein 0.0085 0.2468 0.2477
Plasmodium vivax fructose 1,6-bisphosphate aldolase, putative 0.0098 0.2953 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Schistosoma mansoni thyroid hormone receptor 0.0028 0.049 0.0476
Loa Loa (eye worm) intermediate filament protein 0.0027 0.044 0.0444
Brugia malayi Steroid receptor seven-up type 2 0.0028 0.049 0.0495
Mycobacterium tuberculosis Probable phytoene synthase PhyA 0.0085 0.2468 0.5292
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0028 0.049 0.0867
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0043 0.0044
Trypanosoma cruzi DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Brugia malayi ImpB/MucB/SamB family protein 0.0016 0.0043 0.0044
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0098 0.2953 0.5401
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0863 0.1553
Schistosoma mansoni steroid hormone receptor ad4bp 0.0028 0.049 0.0476
Loa Loa (eye worm) hypothetical protein 0.0017 0.0094 0.0095
Schistosoma mansoni DNA polymerase eta 0.0016 0.0043 0.0024
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Trypanosoma brucei DNA polymerase kappa, putative 0.0018 0.0124 0.0089
Leishmania major cysteine peptidase A (CPA) 0.0017 0.0094 0.0056
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0046 0.1116 0.3574
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Toxoplasma gondii fructose-bisphosphate aldolase, putative 0.0098 0.2953 1
Brugia malayi fructose-bisphosphate aldolase 2 0.0098 0.2953 0.2981
Trypanosoma cruzi cruzipain precursor, putative 0.0065 0.1786 0.1937
Schistosoma mansoni fructose 16-bisphosphate aldolase 0.0098 0.2953 0.2967
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0231 0.7636 0.7709
Brugia malayi Cytochrome P450 family protein 0.0045 0.1071 0.1081
Giardia lamblia Histone acetyltransferase GCN5 0.0042 0.098 0.0707
Loa Loa (eye worm) cytochrome P450 family protein 0.0045 0.1071 0.1081
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0028 0.049 0.0495
Brugia malayi nuclear hormone receptor 0.0028 0.049 0.0495
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Leishmania major DNA polymerase kappa, putative 0.0023 0.0295 0.0279
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0098 0.2953 0.5401
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0028 0.049 0.0495
Brugia malayi nuclear receptor NHR-88 0.0028 0.049 0.0495
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0028 0.049 0.0495
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1786 0.1937
Loa Loa (eye worm) fructose-bisphosphate aldolase 2 0.0098 0.2953 0.2981
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0098 0.2953 0.5401
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0028 0.049 0.0867
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Onchocerca volvulus NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog 0.0085 0.2468 1
Echinococcus granulosus geminin 0.0169 0.5451 1
Echinococcus multilocularis cysteine protease 0.0017 0.0094 0.0138
Schistosoma mansoni hypothetical protein 0.0169 0.5451 0.5494
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0094 0.0138
Onchocerca volvulus 0.0071 0.2004 0.8046
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0863 0.0853
Trypanosoma cruzi squalene synthase, putative 0.0271 0.904 1
Loa Loa (eye worm) hypothetical protein 0.005 0.1245 0.1257
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.069 0.0697
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Trypanosoma cruzi DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0028 0.049 0.0476
Loa Loa (eye worm) hypothetical protein 0.0085 0.2468 0.2492
Loa Loa (eye worm) fructose-bisphosphate aldolase 1 0.0098 0.2953 0.2981
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Echinococcus granulosus Squalene phytoene synthase 0.0085 0.2468 0.4509
Echinococcus granulosus histone acetyltransferase KAT2B 0.0153 0.4859 0.891
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0016 0.0043 0.0024
Echinococcus granulosus cathepsin L cysteine proteinase 0.0017 0.0094 0.0138
Echinococcus granulosus cathepsin l cysteine peptidase 0.0017 0.0094 0.0138
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0028 0.049 0.0495
Schistosoma mansoni hypothetical protein 0.0016 0.0047 0.0028
Entamoeba histolytica hypothetical protein 0.0039 0.0863 0.0823
Schistosoma mansoni hypothetical protein 0.0074 0.2092 0.2096
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0028 0.049 0.0495
Leishmania major squalene synthase, putative 0.0271 0.904 1
Leishmania major cathepsin L-like protease 0.0065 0.1786 0.1937
Loa Loa (eye worm) cysteine protease 0.0017 0.0094 0.0095
Schistosoma mansoni jun-related protein 0.0074 0.2092 0.2096
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0863 0.1553
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0028 0.049 0.0495
Brugia malayi hypothetical protein 0.0071 0.2004 0.2023
Echinococcus multilocularis GPCR, family 2 0.0016 0.0047 0.005
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0146 0.4625 1
Leishmania major fructose-1,6-bisphosphate aldolase 0.0098 0.2953 0.3234
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0047 0.005
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.044 0.0444
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0019 0.0019
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0028 0.049 0.0867
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0016 0.0043 0.0044
Echinococcus granulosus cathepsin l1 0.0017 0.0094 0.0138
Schistosoma mansoni lamin 0.0027 0.044 0.0426
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0047 0.0047
Loa Loa (eye worm) hypothetical protein 0.0026 0.0423 0.0427
Trichomonas vaginalis DNA polymerase eta, putative 0.0044 0.1056 0.0971
Echinococcus multilocularis lamin 0.0027 0.044 0.0775
Echinococcus granulosus dna polymerase kappa 0.0044 0.1056 0.1909
Schistosoma mansoni glutaminase 0.0296 0.9906 1
Schistosoma mansoni fructose 16-bisphosphate aldolase 0.0098 0.2953 0.2967
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0028 0.049 0.0476
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.044 0.0444
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0028 0.049 0.0867
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Echinococcus granulosus fructose bisphosphate aldolase class I 0.0098 0.2953 0.5401
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Brugia malayi ImpB/MucB/SamB family protein 0.0016 0.0043 0.0044
Trypanosoma brucei squalene synthase, putative 0.0271 0.904 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0028 0.049 0.0495
Trypanosoma cruzi DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0019
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0028 0.049 0.0867
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0023 0.0295 0.0549
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0047 0.0047
Trypanosoma brucei unspecified product 0.0037 0.0805 0.0847
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0094 0.0076
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Schistosoma mansoni hypothetical protein 0.0016 0.0047 0.0028
Echinococcus multilocularis cysteine protease 0.0017 0.0094 0.0138
Trypanosoma brucei DNA polymerase kappa, putative 0.0044 0.1056 0.1126
Schistosoma mansoni lamin 0.0027 0.044 0.0426
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0098 0.2953 0.3234
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0047 0.005
Brugia malayi intermediate filament protein 0.0027 0.044 0.0444
Entamoeba histolytica hypothetical protein 0.0039 0.0863 0.0823
Echinococcus multilocularis dna polymerase eta 0.0016 0.0043 0.0044
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1786 0.1937
Trypanosoma brucei DNA polymerase IV, putative 0.0037 0.0805 0.0847
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0091 0.2691 0.4919
Schistosoma mansoni nuclear hormone receptor 0.0028 0.049 0.0476
Trypanosoma brucei DNA polymerase kappa, putative 0.0018 0.0124 0.0089
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0028 0.049 0.0495
Echinococcus granulosus lamin dm0 0.0027 0.044 0.0775
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0028 0.049 0.0867
Trypanosoma cruzi squalene synthase, putative 0.0271 0.904 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.1245 0.1257
Brugia malayi hypothetical protein 0.0015 0.0019 0.0019
Echinococcus multilocularis musashi 0.0027 0.044 0.0775
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0028 0.049 0.0867
Echinococcus multilocularis FTZ F1 alpha 0.0028 0.049 0.0867
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0098 0.2953 0.3234
Brugia malayi acetyltransferase, GNAT family protein 0.0157 0.5013 0.5061
Schistosoma mansoni hypothetical protein 0.0016 0.0047 0.0028
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0098 0.2953 0.3234
Trypanosoma brucei DNA polymerase kappa, putative 0.0034 0.0676 0.0703
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0028 0.049 0.0495
Schistosoma mansoni RAR-like nuclear receptor 0.0028 0.049 0.0476
Echinococcus granulosus histone acetyltransferase KAT2B 0.0046 0.1116 0.2019
Brugia malayi Nuclear hormone receptor-like 1 0.0015 0.0019 0.0019
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0098 0.2953 0.3234
Loa Loa (eye worm) hypothetical protein 0.0027 0.044 0.0444
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0047 0.005
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.1245 0.1257
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Brugia malayi Papain family cysteine protease containing protein 0.0017 0.0094 0.0095
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0098 0.2953 0.5401
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.0295 0.0279
Echinococcus granulosus dna polymerase eta 0.0016 0.0043 0.0044
Loa Loa (eye worm) hypothetical protein 0.0028 0.049 0.0495
Schistosoma mansoni retinoic acid receptor RXR 0.0028 0.049 0.0476
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Echinococcus multilocularis Squalene phytoene synthase 0.0085 0.2468 0.4509
Brugia malayi follicle stimulating hormone receptor 0.0231 0.7636 0.7709
Mycobacterium ulcerans phytoene synthase, CrtB 0.0085 0.2468 0.1595
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0157 0.5013 0.5052
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0028 0.049 0.0495
Leishmania major hypothetical protein, conserved 0.0085 0.2468 0.2695
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0028 0.049 0.0495
Loa Loa (eye worm) hypothetical protein 0.0015 0.0019 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0028 0.049 0.0495
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0094 0.0138
Brugia malayi hypothetical protein 0.0015 0.0019 0.0019
Loa Loa (eye worm) hypothetical protein 0.0034 0.069 0.0697
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0044 0.1056 0.0971
Leishmania major cathepsin L-like protease 0.0017 0.0094 0.0056
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0098 0.2953 0.5401
Loa Loa (eye worm) glutaminase 2 0.0296 0.9906 1
Echinococcus multilocularis geminin 0.0169 0.5451 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0028 0.049 0.1668
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Leishmania major cathepsin L-like protease 0.0017 0.0094 0.0056
Loa Loa (eye worm) hypothetical protein 0.0088 0.2603 0.2628
Echinococcus granulosus GPCR family 2 0.0016 0.0047 0.005
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Plasmodium falciparum histone acetyltransferase GCN5 0.0042 0.098 0.3101
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0028 0.049 0.0867
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0091 0.2691 0.4919
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0028 0.049 0.0867
Trypanosoma cruzi major cysteine proteinase, putative 0.0051 0.1295 0.1391
Schistosoma mansoni thyroid hormone receptor 0.0028 0.049 0.0476
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0017 0.0094 0.0095
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.1245 0.1257
Leishmania major cathepsin L-like protease 0.0017 0.0094 0.0056
Schistosoma mansoni terminal deoxycytidyl transferase 0.0016 0.0043 0.0024
Echinococcus multilocularis fructose bisphosphate aldolase class I 0.0098 0.2953 0.5401
Entamoeba histolytica hypothetical protein 0.0039 0.0863 0.0823
Trypanosoma cruzi cysteine peptidase, putative 0.0065 0.1786 0.1937
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0028 0.049 0.0867
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0098 0.2953 0.5401
Trypanosoma brucei DNA polymerase IV, putative 0.0044 0.1056 0.1126
Brugia malayi nuclear receptor RXR 0.0015 0.0019 0.0019
Entamoeba histolytica hypothetical protein 0.0039 0.0863 0.0823
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0028 0.049 0.0495
Entamoeba histolytica cysteine proteinase, putative 0.0017 0.0094 0.0051
Leishmania major cathepsin L-like protease 0.0017 0.0094 0.0056
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Loa Loa (eye worm) steroid hormone receptor 0.0028 0.049 0.0495
Trypanosoma brucei DNA polymerase kappa, putative 0.0018 0.0124 0.0089
Entamoeba histolytica cysteine proteinase, putative 0.0017 0.0094 0.0051
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0047 0.0047
Echinococcus granulosus intermediate filament protein 0.0027 0.044 0.0775
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 1 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0028 0.049 0.0495
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0157 0.5013 0.9195
Echinococcus multilocularis jun protein 0.0091 0.2691 0.4919
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0046 0.1116 0.3574
Echinococcus multilocularis ecdysone induced protein 78C 0.0028 0.049 0.0867
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0017 0.0094 0.0095
Brugia malayi fructose-bisphosphate aldolase 1 0.0098 0.2953 0.2981
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0016 0.0043 0.0044
Brugia malayi Cathepsin L-like precursor 0.0017 0.0094 0.0095
Loa Loa (eye worm) ctsf protein 0.0017 0.0094 0.0095
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0065 0.1786 0.1937
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0028 0.049 0.0495
Echinococcus granulosus lamin 0.0027 0.044 0.0775
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0146 0.4625 0.4033
Loa Loa (eye worm) glutaminase 0.0296 0.9906 1

Activities

Activity type Activity value Assay description Source Reference
MIC (functional) = 1.56 ug ml-1 Antimicrobial activity against the strain of Candida albicans(AMB 25) ChEMBL. 3309312
MIC (functional) = 1.56 ug ml-1 Antimicrobial activity against the strain of Candida albicans(AMB 25) ChEMBL. 3309312
MIC (functional) > 200 ug ml-1 Antimicrobial activity against the strain of Staphylococcus aureus (209P) ChEMBL. 3309312
MIC (functional) > 200 ug ml-1 Antimicrobial activity against the strain of Bacillus pumilus(1697) ChEMBL. 3309312
MIC (functional) > 200 ug ml-1 Antimicrobial activity against the strain of Shigella sonnei(433) ChEMBL. 3309312
MIC (functional) > 200 ug ml-1 Antimicrobial activity against the strain of Escherichia coli(ATCC 9637) ChEMBL. 3309312
MIC (functional) > 200 ug ml-1 Antimicrobial activity against the strain of Escherichia coli(ATCC 9637) ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of Met-Val dipeptide antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of Leu-Met dipeptide antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of GlcNAc antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of Met-Val dipeptide antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of Leu-Met dipeptide antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 0 mM Antifungal activity against Candida albicans ATCC 26278 strain in medium after incorporation of 10 nmol of GlcNAc antagonist per disk. ChEMBL. 3309312
Zone size (functional) = 31 mM Antifungal activity against Candida albicans ATCC 26278 strain in YNB medium after incorporation of 10 ug of the compound per disk. ChEMBL. 3309312
Zone size (functional) = 31 mM Antifungal activity against Candida albicans ATCC 26278 strain in YNB medium after incorporation of 10 ug of the compound per disk. ChEMBL. 3309312
Zone size (functional) = 35 mM Antifungal activity against Candida albicans ATCC 26278 strain in YNB medium after incorporation of 20 ug of the compound per disk. ChEMBL. 3309312
Zone size (functional) = 35 mM Antifungal activity against Candida albicans ATCC 26278 strain in YNB medium after incorporation of 20 ug of the compound per disk. ChEMBL. 3309312

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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