Detailed information for compound 30578

Basic information

Technical information
  • TDR Targets ID: 30578
  • Name: benzyl N-[(3S)-1-methyl-2,6-dioxopiperidin-3- yl]carbamate
  • MW: 276.288 | Formula: C14H16N2O4
  • H donors: 1 H acceptors: 3 LogP: 0.85 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1C(=O)CC[C@@H](C1=O)NC(=O)OCc1ccccc1
  • InChi: 1S/C14H16N2O4/c1-16-12(17)8-7-11(13(16)18)15-14(19)20-9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,19)/t11-/m0/s1
  • InChiKey: VPHDQSBDBUNJGU-NSHDSACASA-N  


Substructure search Similarity search

Network

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Synonyms

  • benzyl N-[(3S)-1-methyl-2,6-dioxo-3-piperidyl]carbamate
  • N-[(3S)-1-methyl-2,6-dioxo-3-piperidinyl]carbamic acid benzyl ester
  • phenylmethyl N-[(3S)-1-methyl-2,6-dioxo-piperidin-3-yl]carbamate
  • N-[(3S)-2,6-diketo-1-methyl-3-piperidyl]carbamic acid benzyl ester
  • phenylmethyl N-[(3S)-1-methyl-2,6-dioxopiperidin-3-yl]carbamate
  • phenylmethyl N-[(3S)-1-methyl-2,6-dioxo-3-piperidyl]carbamate
  • N-[(3S)-1-methyl-2,6-dioxo-3-piperidinyl]carbamic acid phenylmethyl ester

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 brucei adenylyl cyclase, frameshift 0.0066 0.0089 0.2493
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0039 0.0073
Echinococcus multilocularis sterol regulatory element binding protein 0.0058 0.0061 0.0113
Echinococcus granulosus receptor type guanylyl cyclase 0.0066 0.0089 0.0108
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Leishmania major receptor-type adenylate cyclase b 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 5 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0142 0.0356 0.827
Trichomonas vaginalis adenylate cyclase type IX, putative 0.0066 0.0089 0.2062
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium tuberculosis Probable conserved transmembrane protein 0.0066 0.0089 0.1128
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Loa Loa (eye worm) transcription factor SMAD2 0.0137 0.0338 0.0338
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus granulosus retinal guanylyl cyclase 2 0.0066 0.0089 0.0108
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0079 0.0133 0.3091
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Brugia malayi hypothetical protein 0.0161 0.0425 0.0792
Echinococcus multilocularis adenylate cyclase type IX 0.1372 0.4718 0.8783
Mycobacterium tuberculosis Possible adenylate cyclase (ATP pyrophosphate-lyase) (adenylyl cyclase) 0.0066 0.0089 0.1128
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0039 0.0917
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0066 0.0089 0.2079
Mycobacterium tuberculosis Possible adenylate cyclase (ATP pyrophosphate-lyase) (adenylyl cyclase) 0.0066 0.0089 0.1128
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0163 0.043 0.0522
Mycobacterium ulcerans hypothetical protein 0.0066 0.0089 0.2493
Trypanosoma brucei Adenylate and Guanylate cyclase catalytic domain containing protein, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Brugia malayi hypoxia-induced factor 1 0.0149 0.0381 0.071
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase type III, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans adenylate or guanylate cyclase 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0066 0.0089 0.2062
Echinococcus granulosus retinal guanylyl cyclase 2 0.0066 0.0089 0.0108
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.0165
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis adenylate cyclase 0.0066 0.0089 0.0165
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0039 0.0917
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0066 0.0089 0.2062
Leishmania major adenylate cyclase-like protein 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase type vIII, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans adenylylate/guanylate cyclase 0.0066 0.0089 0.2493
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Leishmania major receptor-type adenylate cyclase b 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase beta 1 subunit, putative 0.0066 0.0089 0.2062
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.0165
Trichomonas vaginalis hypothetical protein 0.0066 0.0089 0.2062
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0263 0.0787 1
Loa Loa (eye worm) guanylyl cyclase/natriuretic peptide receptor 0.0066 0.0089 0.0089
Plasmodium falciparum hexose transporter 0.0163 0.043 1
Mycobacterium leprae Probable conserved transmembrane protein 0.0066 0.0089 1
Echinococcus multilocularis atrial natriuretic peptide receptor 1 0.0066 0.0089 0.0165
Echinococcus multilocularis adenylate cyclase 9 0.0066 0.0089 0.0165
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0039 0.0048
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium tuberculosis Probable transcriptional regulatory protein (probably LuxR/UhpA-family) 0.0066 0.0089 0.1128
Schistosoma mansoni single-minded 0.0048 0.0024 0.0566
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase type VI, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Onchocerca volvulus 0.1557 0.5371 1
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Loa Loa (eye worm) RGC/RGC protein kinase 0.0066 0.0089 0.0089
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0066 0.0089 0.0165
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0058 0.0061 0.0061
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Onchocerca volvulus 0.0066 0.0089 0.0165
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0163 0.043 0.0522
Schistosoma mansoni hypothetical protein 0.0066 0.0089 0.2062
Echinococcus multilocularis protein dispatched 1 0.0058 0.0061 0.0113
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Schistosoma mansoni hypothetical protein 0.0066 0.0089 0.2062
Echinococcus granulosus Protein patched homolog 1 0.0058 0.0061 0.0074
Echinococcus multilocularis Niemann Pick C1 protein 0.0058 0.0061 0.0113
Echinococcus granulosus adenylate cyclase 0.0066 0.0089 0.0108
Trichomonas vaginalis guanylate cyclase, putative 0.0079 0.0133 0.3091
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylyl cyclase type V, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.0161 0.0425 0.0425
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0079 0.0133 0.3091
Onchocerca volvulus 0.0066 0.0089 0.0165
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 1 0.0066 0.0089 0.2493
Loa Loa (eye worm) hypothetical protein 0.1491 0.5137 0.5137
Schistosoma mansoni protein tyrosine kinase 0.0066 0.0089 0.2062
Mycobacterium ulcerans LuxR family transcriptional regulator 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase beta 2 subunit, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans hypothetical protein 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Toxoplasma gondii adenylate and guanylate cyclase catalytic domain-containing protein 0.0066 0.0089 0.2062
Toxoplasma gondii guanylyl cyclase 0.0066 0.0089 0.2062
Echinococcus multilocularis adenylate cyclase 9 0.1557 0.5371 1
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 4 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Onchocerca volvulus Adenylate cyclase type 3 homolog 0.1557 0.5371 1
Schistosoma mansoni serine/threonine RGC 0.0066 0.0089 0.2062
Brugia malayi Guanylyl cyclase protein 23 0.0066 0.0089 0.0165
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis atrial natriuretic peptide receptor, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Echinococcus granulosus sterol regulatory element binding protein 0.0058 0.0061 0.0074
Trichomonas vaginalis atrial natriuretic peptide receptor, putative 0.0066 0.0089 0.2062
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 2 0.0066 0.0089 0.2493
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0142 0.0356 1
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase, putative 0.0079 0.0133 0.3091
Plasmodium vivax Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.2062
Leishmania major receptor-type adenylate cyclase b 0.0066 0.0089 0.2493
Echinococcus multilocularis protein patched 0.0058 0.0061 0.0113
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0163 0.043 0.0522
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0163 0.043 0.0801
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) RGC/RGC protein kinase 0.0066 0.0089 0.0089
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0163 0.043 0.0801
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Mycobacterium tuberculosis Possible adenylate cyclase (ATP pyrophosphate-lyase) (adenylyl cyclase) 0.0066 0.0089 0.1128
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.0165
Plasmodium vivax hexose transporter 0.0163 0.043 1
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Schistosoma mansoni glucose transport protein 0.0163 0.043 1
Trichomonas vaginalis adenylate cyclase type IX, putative 0.0066 0.0089 0.2062
Schistosoma mansoni aryl hydrocarbon receptor 0.0048 0.0024 0.0566
Mycobacterium tuberculosis Possible transcriptional regulatory protein 0.0066 0.0089 0.1128
Loa Loa (eye worm) RGC/RGC protein kinase 0.0066 0.0089 0.0089
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Leishmania major receptor-type adenylate cyclase b 0.0066 0.0089 0.2493
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0066 0.0089 0.0165
Loa Loa (eye worm) sugar transporter 0.0163 0.043 0.043
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Schistosoma mansoni receptor-type adenylate cyclase 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans adenylate cyclase CyaA 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium leprae conserved hypothetical protein 0.0066 0.0089 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Schistosoma mansoni hypothetical protein 0.0066 0.0089 0.2062
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0163 0.043 0.0801
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0142 0.0356 1
Treponema pallidum adenylate cyclase 0.0066 0.0089 0.5
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0079 0.0133 0.3091
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0066 0.0089 0.0165
Echinococcus granulosus General substrate transporter 0.0137 0.0338 0.041
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.0039 0.0039
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase type, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.1557 0.5371 0.5371
Schistosoma mansoni adenylate cyclase 0.0066 0.0089 0.2062
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0229 0.0665 0.0665
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Leishmania major receptor-type adenylate cyclase a-like protein 0.0066 0.0089 0.2493
Toxoplasma gondii adenylate and guanylate cyclase catalytic domain-containing protein 0.0066 0.0089 0.2062
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Echinococcus granulosus adenylate cyclase 9 0.1557 0.5371 0.6513
Brugia malayi hypothetical protein 0.0066 0.0089 0.0165
Echinococcus multilocularis General substrate transporter 0.0137 0.0338 0.0629
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans lignin peroxidase LipJ 0.0066 0.0089 0.2493
Schistosoma mansoni receptor-type adenylate cyclase 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase type III, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis receptor type guanylyl cyclase 0.0066 0.0089 0.0165
Echinococcus granulosus atrial natriuretic peptide receptor 1 0.0066 0.0089 0.0108
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, frameshift 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, type VII, putative 0.0079 0.0133 0.3091
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0079 0.0133 0.3091
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Brugia malayi adenylate cyclase, type IX 0.0066 0.0089 0.0165
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Brugia malayi Sugar transporter family protein 0.0163 0.043 0.0801
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.0142 0.0356 0.0356
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0066 0.0089 0.2493
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Brugia malayi follicle stimulating hormone receptor 0.0229 0.0665 0.1238
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.0058 0.0061 0.0061
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Brugia malayi MH2 domain containing protein 0.0137 0.0338 0.0629
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Loa Loa (eye worm) hypoxia-induced factor 1 0.0149 0.0381 0.0381
Mycobacterium tuberculosis Conserved hypothetical protein 0.0066 0.0089 0.1128
Brugia malayi CHE-14 protein 0.0058 0.0061 0.0113
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0079 0.0133 0.3091
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Schistosoma mansoni glucose transport protein 0.0163 0.043 1
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Onchocerca volvulus Adenylate cyclase type 2 homolog 0.1557 0.5371 1
Plasmodium vivax guanylyl cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis intestinal guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Echinococcus granulosus retinal guanylyl cyclase 2 0.0066 0.0089 0.0108
Schistosoma mansoni adenylate cyclase 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Mycobacterium leprae possible transcriptional regulatory protein 0.0066 0.0089 1
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0058 0.0061 0.1409
Schistosoma mansoni patched 1 0.0058 0.0061 0.1409
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0039 0.0917
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Trichomonas vaginalis adenylate cyclase type IX, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0066 0.0089 0.2062
Mycobacterium tuberculosis Probable lignin peroxidase LipJ 0.0066 0.0089 0.1128
Trichomonas vaginalis adenylate cyclase type, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0142 0.0356 1
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0163 0.043 0.0522
Echinococcus granulosus adenylate cyclase type IX 0.1372 0.4718 0.572
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis retinal guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0163 0.043 0.0801
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 6 0.0066 0.0089 0.2493
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0066 0.0089 0.2079
Toxoplasma gondii adenylate cyclase, putative 0.0066 0.0089 0.2062
Loa Loa (eye worm) RGC/RGC protein kinase 0.0066 0.0089 0.0089
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.0165
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Mycobacterium ulcerans hypothetical protein 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.0066 0.0089 1
Mycobacterium ulcerans hypothetical protein 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Echinococcus granulosus Solute carrier family 22 5 0.2368 0.8247 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.0039 0.0073
Loa Loa (eye worm) MH2 domain-containing protein 0.0137 0.0338 0.0338
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0039 0.0073
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Trichomonas vaginalis soluble guanylate cyclase gcy, putative 0.0066 0.0089 0.2062
Brugia malayi PAS domain containing protein 0.0048 0.0024 0.0045
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0142 0.0356 0.0663
Schistosoma mansoni adenylate cyclase 0.0066 0.0089 0.2062
Trypanosoma brucei STE/STE11 serine/threonine-protein kinase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0142 0.0356 0.0663
Brugia malayi Adenylyl cyclase protein 0.1557 0.5371 1
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei procyclic-enriched flagellar receptor adenylate cyclase 3 0.0066 0.0089 0.2493
Echinococcus granulosus adenylate cyclase 9 0.0066 0.0089 0.0108
Schistosoma mansoni glucose transport protein 0.0163 0.043 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase type III, putative 0.0066 0.0089 0.2062
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase type, putative 0.0066 0.0089 0.2062
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0142 0.0356 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.0089 0.0089
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Brugia malayi Receptor family ligand binding region containing protein 0.0066 0.0089 0.0165
Trichomonas vaginalis adenylate cyclase type VI, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Onchocerca volvulus 0.0066 0.0089 0.0165
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Leishmania major receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Echinococcus multilocularis adenylate cyclase 9 0.0066 0.0089 0.0165
Schistosoma mansoni hypothetical protein 0.0163 0.043 1
Schistosoma mansoni soluble guanylate cyclase gcy 0.0066 0.0089 0.2062
Brugia malayi Adenylate and Guanylate cyclase catalytic domain containing protein 0.0066 0.0089 0.0165
Echinococcus multilocularis retinal guanylyl cyclase 2 0.0066 0.0089 0.0165
Trypanosoma brucei expression site-associated gene 4 (ESAG4) protein, putative 0.0066 0.0089 0.2493
Plasmodium vivax adenylyl cyclase beta, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0066 0.0089 0.2079
Leishmania major receptor-type adenylate cyclase a 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis retinal guanylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylate cyclase type IX, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis adenylyl cyclase type V, putative 0.0066 0.0089 0.2062
Trypanosoma cruzi receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0142 0.0356 1
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Trypanosoma brucei adenylyl cyclase 0.0066 0.0089 0.2493
Mycobacterium ulcerans adenylate cyclase 0.0066 0.0089 0.2493
Schistosoma mansoni protein kinase 0.0066 0.0089 0.2062
Trichomonas vaginalis conserved hypothetical protein 0.0058 0.0061 0.1409
Trypanosoma brucei expression site associated gene (ESAG) 4 protein, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Toxoplasma gondii facilitative glucose transporter GT1 0.0163 0.043 1
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0142 0.0356 0.0432
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis adenylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase, putative 0.0066 0.0089 0.2493
Trichomonas vaginalis conserved hypothetical protein 0.0163 0.043 1
Onchocerca volvulus 0.1491 0.5137 0.9563
Trichomonas vaginalis adenylate and guanylate cyclases, putative 0.0066 0.0089 0.2062
Trichomonas vaginalis guanylate cyclase beta 2 subunit, putative 0.0066 0.0089 0.2062
Echinococcus granulosus Niemann Pick C1 protein 0.0058 0.0061 0.0074
Trichomonas vaginalis guanylate cyclase, putative 0.0066 0.0089 0.2062
Trypanosoma brucei receptor-type adenylate cyclase GRESAG 4, putative 0.0066 0.0089 0.2493
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0039 0.0048

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 12.5 mg kg-1 Compound was tested for anticonvulsant activity in male mice by pentylenetetrazole (80mg/kg,Sc.) induced seizure test. ChEMBL. No reference
ED50 (functional) = 12.5 mg kg-1 Compound was tested for anticonvulsant activity in male mice by pentylenetetrazole (80mg/kg,Sc.) induced seizure test. ChEMBL. No reference
ED50 (functional) = 36.1 mg kg-1 Compound was tested for anticonvulsant activity in male mice using maximal electric shock seizure test. ChEMBL. No reference
ED50 (functional) = 36.1 mg kg-1 Compound was tested for anticonvulsant activity in male mice using maximal electric shock seizure test. ChEMBL. No reference
PI (ADMET) = 1.7 Compound was tested for anticonvulsant activity in male mice using maximal electric shock seizure test; Protective index = TD50/ED50 ChEMBL. No reference
PI (ADMET) = 5 Compound was tested for anticonvulsant activity in male mice by pentylenetetrazole (80mg/kg,Sc.) induced seizure test.; Protective index = TD50/ED50 ChEMBL. No reference
TD50 (ADMET) = 62.5 mg kg-1 Compound was tested for neurotoxic activity in male mice using rotorod test. 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.

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