Detailed information for compound 1104671

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 430.525 | Formula: C18H30N2O8Si
  • H donors: 3 H acceptors: 6 LogP: 0.62 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)Cn1c(=O)n(cc(c1=O)C)C1O[C@@H]([C@H]([C@H]1O)O)CO[Si](C(C)(C)C)(C)C
  • InChi: 1S/C18H30N2O8Si/c1-10-7-20(17(26)19(15(10)25)8-12(21)22)16-14(24)13(23)11(28-16)9-27-29(5,6)18(2,3)4/h7,11,13-14,16,23-24H,8-9H2,1-6H3,(H,21,22)/t11-,13-,14-,16?/m1/s1
  • InChiKey: RVBGPCQZIQSCKC-FLYGSYRRSA-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
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Plasmodium vivax multidomain scavenger receptor, putative 0.0039 0.0174 0.012
Schistosoma mansoni hypothetical protein 0.0039 0.0174 0.0129
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Echinococcus multilocularis lipoxygenase domain containing protein 0.0039 0.0174 0.0035
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0097 0.1571 0.3113
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0446 1 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.0083 0.1246 0.4188
Mycobacterium ulcerans Type I modular polyketide synthase 0.0104 0.1735 0.5834
Mycobacterium ulcerans fatty acid synthase Fas 0.0033 0.0017 0.0056
Onchocerca volvulus 0.0181 0.3591 0.7245
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0684 0.0641
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0225 0.0152
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0064 0.0783 0.0653
Echinococcus granulosus Polycystic kidney disease protein 0.0039 0.0174 0.0035
Schistosoma mansoni loxhd1 0.0039 0.0174 0.0129
Echinococcus multilocularis Polycystic kidney disease protein 0.0039 0.0174 0.0035
Entamoeba histolytica phosphofructokinase, putative 0.0108 0.1833 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0083 0.1246 0.4188
Onchocerca volvulus 0.0235 0.4903 1
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.027 0.5759 0.5759
Brugia malayi beta-lactamase family protein 0.0038 0.014 0.014
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0104 0.1735 0.1735
Schistosoma mansoni 6-phosphofructokinase 0.0108 0.1833 0.1795
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0811 0.2348
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0811 0.068
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0101 0.1659 0.3287
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0225 0.0152
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0069 0.0887 0.2941
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0446 1 1
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0097 0.1571 0.1532
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0684 0.2299
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0064 0.0783 0.2252
Loa Loa (eye worm) hypothetical protein 0.0174 0.3439 0.3409
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0101 0.1659 0.3287
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0225 0.0152
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.014 0.047
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0424 0.0424
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0038 0.0149 0.0017
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.014 0.0277
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0104 0.1735 0.344
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0155 0.2975 0.5896
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0684 0.0641
Echinococcus multilocularis L aminoadipate semialdehyde 0.0082 0.1221 0.1096
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0684 0.2299
Echinococcus granulosus lipoxygenase domain containing protein 0.0039 0.0174 0.0035
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Schistosoma mansoni polycystin 1-related 0.0039 0.0174 0.0129
Mycobacterium leprae conserved hypothetical protein 0.0038 0.014 0.0416
Plasmodium falciparum LCCL domain-containing protein 0.0039 0.0174 0.5
Mycobacterium ulcerans 6-phosphofructokinase 0.0108 0.1833 0.6162
Loa Loa (eye worm) acyl carrier protein 0.0048 0.0382 0.0338
Echinococcus granulosus RUN 0.0039 0.0174 0.0035
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0206 0.4214 0.4188
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0082 0.1221 0.1221
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.2348
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0325 0.0188
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0064 0.0783 0.2252
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0082 0.1221 0.1181
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.0075 0.103 0.2041
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0108 0.1833 0.5
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0064 0.0783 0.2252
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium tuberculosis Conserved protein 0.0038 0.014 0.0277
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0038 0.0149 0.0017
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0038 0.0149 0.001
Onchocerca volvulus Glucosylceramidase homolog 0.0177 0.3514 0.7083
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0684 0.0552
Brugia malayi phosphofructokinase 0.0108 0.1833 0.1833
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0811 0.0811
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Mycobacterium tuberculosis Polyketide synthase Pks12 0.011 0.1891 0.3748
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0156 0.2997 0.2898
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0064 0.0783 0.1145
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0325 0.0281
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0069 0.0887 0.2981
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium ulcerans hypothetical protein 0.0038 0.014 0.047
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium ulcerans thioesterase 0.0086 0.1318 0.443
Trichomonas vaginalis glucosylceramidase, putative 0.0187 0.3744 0.6415
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0108 0.1833 0.3633
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0049 0.0422 0.0986
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.014 0.0094
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0064 0.0783 0.2252
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0155 0.2975 0.5896
Loa Loa (eye worm) fatty acid synthase 0.0102 0.1702 0.1664
Onchocerca volvulus 0.0039 0.0174 0.0072
Loa Loa (eye worm) hypothetical protein 0.0039 0.0174 0.0129
Onchocerca volvulus 0.0082 0.1221 0.227
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Echinococcus granulosus L aminoadipate semialdehyde 0.0082 0.1221 0.1096
Mycobacterium ulcerans Type I modular polyketide synthase 0.0104 0.1735 0.5834
Loa Loa (eye worm) hypothetical protein 0.0039 0.0174 0.0129
Brugia malayi hypothetical protein 0.0039 0.0174 0.0174
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.014 0.047
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0042 0.0243 0.0481
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.011 0.1891 0.3748
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.011 0.1891 0.3748
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0156 0.2997 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0104 0.1735 0.5834
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0811 0.068
Mycobacterium ulcerans thioesterase TesA 0.0086 0.1318 0.443
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0811 0.0768
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.011 0.1891 0.6357
Toxoplasma gondii hypothetical protein 0.0041 0.0225 0.0299
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Trichomonas vaginalis phosphofructokinase, putative 0.0108 0.1833 0.3013
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0156 0.2997 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0325 0.0188
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0064 0.0783 0.1145
Trichomonas vaginalis phosphofructokinase, putative 0.0108 0.1833 0.3013
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0156 0.2997 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0811 0.0768
Loa Loa (eye worm) PDE1B protein 0.0446 1 1
Trichomonas vaginalis phosphofructokinase, putative 0.0108 0.1833 0.3013
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0064 0.0783 0.0653
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0424 0.0424
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0325 0.0188
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.014 0.0277
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0086 0.1318 0.4398
Trichomonas vaginalis glucosylceramidase, putative 0.0187 0.3744 0.6415
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.014 0.0277
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Loa Loa (eye worm) hypothetical protein 0.0058 0.0634 0.059
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.014 0.0094
Entamoeba histolytica phosphofructokinase, putative 0.0108 0.1833 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0325 0.0188
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium ulcerans Type I modular polyketide synthase 0.0104 0.1735 0.5834
Schistosoma mansoni rab6-interacting 0.0039 0.0174 0.0129
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.0083 0.1246 0.4155
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0156 0.2997 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0049 0.0422 0.0502
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Loa Loa (eye worm) doublecortin family protein 0.0039 0.0174 0.0129
Mycobacterium leprae Probable polyketide synthase Pks1 0.011 0.1891 0.6337
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0684 0.1904
Mycobacterium tuberculosis Conserved protein 0.0038 0.014 0.0277
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0325 0.0281
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.2348
Echinococcus multilocularis RUN 0.0039 0.0174 0.0035
Onchocerca volvulus Fatty acid synthase homolog 0.0187 0.3747 0.7572
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0156 0.2997 1
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0104 0.1735 0.344
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0325 0.0281
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.014 0.0277
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0145 0.0005
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.011 0.1891 0.6357
Mycobacterium ulcerans polyketide synthase Pks9 0.0069 0.0887 0.2981
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.014 0.0277
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0038 0.0149 0.0149
Mycobacterium tuberculosis Probable fatty acid synthase Fas (fatty acid synthetase) 0.0033 0.0017 0.0033
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0446 1 1
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0052 0.0496 0.1246
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0038 0.0149 0.001
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0156 0.2997 1
Loa Loa (eye worm) 6-phosphofructokinase 0.0108 0.1833 0.1795
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0064 0.0783 0.0741
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0684 0.1356
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0108 0.1833 0.5926
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0241 0.5045 1
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.011 0.1891 0.6337
Schistosoma mansoni rab6-interacting 0.0039 0.0174 0.0129
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0067 0.0855 0.2503
Toxoplasma gondii type I fatty acid synthase, putative 0.0074 0.1013 0.3057
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.014 0.0277
Mycobacterium tuberculosis Conserved protein 0.0038 0.014 0.0277
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.014 0.0094
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0046 0.0046
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0172 0.3377 0.3283
Schistosoma mansoni lipoxygenase 0.0101 0.1677 0.1638
Loa Loa (eye worm) phosphofructokinase 0.0108 0.1833 0.1795
Trichomonas vaginalis phosphofructokinase, putative 0.0108 0.1833 0.3013
Mycobacterium ulcerans polyketide synthase Pks13 0.0155 0.2975 1
Echinococcus multilocularis 6 phosphofructokinase 0.0108 0.1833 0.1717
Mycobacterium tuberculosis Polyketide synthetase MbtC (polyketide synthase) 0.0036 0.0091 0.018
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0108 0.1833 0.5926
Leishmania major ATP-dependent phosphofructokinase 0.0108 0.1833 0.5926
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.0197 0.3979 0.3979
Loa Loa (eye worm) hypothetical protein 0.0049 0.0424 0.038
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0325 0.0325
Entamoeba histolytica phosphofructokinase, putative 0.0108 0.1833 1
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.0085 0.1279 0.2535
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Brugia malayi Doublecortin family protein 0.0039 0.0174 0.0174
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Mycobacterium ulcerans polyketide synthase 0.0104 0.1735 0.5834
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0038 0.0149 0.0017
Brugia malayi Pre-SET motif family protein 0.0206 0.4214 0.4214
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0172 0.3377 0.3283
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0145 0.0005
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0684 0.1904
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0104 0.1735 0.344
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.011 0.1891 0.6337
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0684 0.0552
Loa Loa (eye worm) hypothetical protein 0.0038 0.0149 0.0104
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0156 0.2997 0.2898
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.2348
Brugia malayi hypothetical protein 0.0039 0.0174 0.0174
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0104 0.1735 0.581
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0156 0.2997 1
Loa Loa (eye worm) beta-lactamase 0.0038 0.014 0.0094
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.014 0.014
Loa Loa (eye worm) hypothetical protein 0.0038 0.014 0.0094
Trichomonas vaginalis conserved hypothetical protein 0.0064 0.0783 0.1145
Trichomonas vaginalis glucosylceramidase, putative 0.027 0.5759 1
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0064 0.0783 0.1145
Echinococcus multilocularis lipoxygenase domain containing protein 0.0039 0.0174 0.0035
Brugia malayi beta-lactamase family protein 0.0038 0.014 0.014
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0038 0.0149 0.0149
Trichomonas vaginalis set domain proteins, putative 0.0235 0.4903 0.8477
Loa Loa (eye worm) hypothetical protein 0.0082 0.1221 0.1181
Brugia malayi beta-lactamase 0.0038 0.014 0.014
Mycobacterium ulcerans polyketide synthase 0.011 0.1891 0.6357
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0038 0.0149 0.0104
Echinococcus granulosus lipoxygenase domain containing protein 0.0039 0.0174 0.0035
Mycobacterium ulcerans beta-lactamase 0.0038 0.014 0.047
Mycobacterium tuberculosis Probable thioesterase TesA 0.0086 0.1318 0.2612
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0049 0.0422 0.0502
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0059 0.0654 0.1297
Onchocerca volvulus 0.0097 0.1571 0.3004
Schistosoma mansoni 6-phosphofructokinase 0.0108 0.1833 0.1795
Onchocerca volvulus 0.0039 0.0174 0.0072
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0104 0.1735 0.581
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0108 0.1833 0.614
Mycobacterium ulcerans lipase LipD 0.0038 0.014 0.047
Echinococcus granulosus 6 phosphofructokinase 0.0108 0.1833 0.1717
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0064 0.0783 0.2252
Mycobacterium leprae Polyketide synthase Pks13 0.0155 0.2975 1
Mycobacterium leprae Probable lipase LipE 0.0038 0.014 0.0416
Brugia malayi AMP-binding enzyme family protein 0.0097 0.1571 0.1571
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.014 0.0277
Toxoplasma gondii type I fatty acid synthase, putative 0.011 0.1891 0.6129
Brugia malayi 6-phosphofructokinase 0.0108 0.1833 0.1833
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0424 0.038
Loa Loa (eye worm) 6-phosphofructokinase 0.0108 0.1833 0.1795
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0684 0.2299
Schistosoma mansoni lipoxygenase 0.0172 0.3377 0.3346
Trichomonas vaginalis glucosylceramidase, putative 0.0177 0.3514 0.6004
Brugia malayi 6-phosphofructokinase 0.0108 0.1833 0.1833
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0325 0.0281
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.027 0.5759 0.5739
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0064 0.0783 0.1145

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) > 250 uM Concentration of the compound required to reduce the viability of mock-infected CEM cells by 50% ChEMBL. 11714616
EC50 (functional) = 117 uM Effective concentration required to inhibit HIV-1 induced cytopathicity by 50% in CEM cells ChEMBL. 11714616

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.

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