Detailed information for compound 1193016

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 433.504 | Formula: C27H23N5O
  • H donors: 0 H acceptors: 4 LogP: 5.79 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(n1nnnc1Cc1ccc(cc1)c1ccccc1)N(Cc1ccc2c(c1)cccc2)C
  • InChi: 1S/C27H23N5O/c1-31(19-21-13-16-23-9-5-6-10-25(23)17-21)27(33)32-26(28-29-30-32)18-20-11-14-24(15-12-20)22-7-3-2-4-8-22/h2-17H,18-19H2,1H3
  • InChiKey: MPIUVHOJVDFICI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens transient receptor potential cation channel, subfamily V, member 1 Starlite/ChEMBL References
Rattus norvegicus Transient receptor potential cation channel subfamily A member 1 Starlite/ChEMBL References
Homo sapiens monoglyceride lipase Starlite/ChEMBL References
Rattus norvegicus Anandamide amidohydrolase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans hypothetical protein Get druggable targets OG5_127783 All targets in OG5_127783
Plasmodium falciparum esterase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Candida albicans one of two amidase genes similar to S. pombe SPCC550.07 and to S. cerevisiae AMD2 (YDR242W) Get druggable targets OG5_127783 All targets in OG5_127783
Leishmania braziliensis monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma brucei monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma congolense monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Candida albicans similar to YJU3 Get druggable targets OG5_127037 All targets in OG5_127037
Leishmania mexicana monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase Get druggable targets OG5_127037 All targets in OG5_127037
Echinococcus multilocularis ankyrin repeat protein Get druggable targets OG5_132409 All targets in OG5_132409
Mycobacterium ulcerans lysophospholipase Get druggable targets OG5_127037 All targets in OG5_127037
Candida albicans one of two amidase genes similar to S. pombe SPCC550.07 and to S. cerevisiae AMD2 (YDR242W) Get druggable targets OG5_127783 All targets in OG5_127783
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma congolense monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE Get druggable targets OG5_127037 All targets in OG5_127037
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein Get druggable targets OG5_127037 All targets in OG5_127037
Schistosoma japonicum ko:K04984 transient receptor potential cation channel, subfamily A, member 1, putative Get druggable targets OG5_132409 All targets in OG5_132409
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127783 All targets in OG5_127783
Echinococcus granulosus fatty acid amide hydrolase 1 Get druggable targets OG5_127783 All targets in OG5_127783
Trypanosoma congolense monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma cruzi monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Candida albicans one of two amidase genes similar to S. pombe SPCC550.07 and to S. cerevisiae AMD2 (YDR242W) Get druggable targets OG5_127783 All targets in OG5_127783
Schistosoma japonicum Transient receptor potential cation channel subfamily A member 1, putative Get druggable targets OG5_132409 All targets in OG5_132409
Schistosoma mansoni transient receptor potential cation channel subfamily A member Get druggable targets OG5_132409 All targets in OG5_132409
Echinococcus granulosus ankyrin repeat protein Get druggable targets OG5_132409 All targets in OG5_132409
Mycobacterium tuberculosis Possible lysophospholipase Get druggable targets OG5_127037 All targets in OG5_127037
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_127037 All targets in OG5_127037
Echinococcus granulosus fatty acid amide hydrolase 1 Get druggable targets OG5_127783 All targets in OG5_127783
Leishmania infantum monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Echinococcus granulosus transient receptor potential cation channel Get druggable targets OG5_132409 All targets in OG5_132409
Leishmania major monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma brucei gambiense monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Plasmodium falciparum lysophospholipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Candida albicans similar to YJU3 Get druggable targets OG5_127037 All targets in OG5_127037
Plasmodium falciparum lysophospholipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127037 All targets in OG5_127037
Echinococcus multilocularis fatty acid amide hydrolase 1 Get druggable targets OG5_127783 All targets in OG5_127783
Plasmodium falciparum lysophospholipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma brucei gambiense monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Echinococcus multilocularis fatty acid amide hydrolase 1 Get druggable targets OG5_127783 All targets in OG5_127783
Candida albicans hypothetical protein Get druggable targets OG5_127783 All targets in OG5_127783
Schistosoma mansoni amidase Get druggable targets OG5_127783 All targets in OG5_127783
Candida albicans one of two amidase genes similar to S. pombe SPCC550.07 and to S. cerevisiae AMD2 (YDR242W) Get druggable targets OG5_127783 All targets in OG5_127783
Trichomonas vaginalis valacyclovir hydrolase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Schistosoma mansoni fatty-acid amide hydrolase Get druggable targets OG5_127783 All targets in OG5_127783
Schistosoma japonicum Fatty-acid amide hydrolase 1, putative Get druggable targets OG5_127783 All targets in OG5_127783
Plasmodium vivax PST-A protein Get druggable targets OG5_127037 All targets in OG5_127037
Schistosoma japonicum ko:K01175 fatty acid amide hydrolase [EC:3.1.-.-], putative Get druggable targets OG5_127783 All targets in OG5_127783
Echinococcus multilocularis transient receptor potential cation channel Get druggable targets OG5_132409 All targets in OG5_132409
Leishmania donovani monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Brugia malayi amidase Get druggable targets OG5_127783 All targets in OG5_127783
Schistosoma japonicum Fatty-acid amide hydrolase 1, putative Get druggable targets OG5_127783 All targets in OG5_127783
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase Get druggable targets OG5_127037 All targets in OG5_127037
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase Get druggable targets OG5_127037 All targets in OG5_127037
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127037 All targets in OG5_127037
Trypanosoma brucei monoglyceride lipase, putative Get druggable targets OG5_127037 All targets in OG5_127037
Schistosoma japonicum Transient receptor potential cation channel subfamily A member 1, putative Get druggable targets OG5_132409 All targets in OG5_132409
Schistosoma japonicum Transient receptor potential cation channel subfamily A member 1, putative Get druggable targets OG5_132409 All targets in OG5_132409
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein Get druggable targets OG5_127037 All targets in OG5_127037
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum esterase, putative monoglyceride lipase 303 aa 254 aa 19.7 %
Echinococcus multilocularis fatty acid amide hydrolase 1 Anandamide amidohydrolase   579 aa 470 aa 28.3 %
Onchocerca volvulus Anandamide amidohydrolase   579 aa 539 aa 34.7 %
Schistosoma japonicum Fatty-acid amide hydrolase 1, putative Anandamide amidohydrolase   579 aa 499 aa 24.6 %
Echinococcus granulosus fatty acid amide hydrolase 1 Anandamide amidohydrolase   579 aa 470 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0152 0.0604
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0049 0.0056
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0564 0.0641
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.251 1
Echinococcus multilocularis GPCR, family 2 0.0018 0.0184 0.0209
Schistosoma mansoni intermediate filament proteins 0.0028 0.0564 0.0564
Loa Loa (eye worm) amidase 0.0015 0.0087 0.0099
Mycobacterium ulcerans amidase 0.0015 0.0087 0.0348
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.4222 0.4805
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.1352 0.1538
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.0978 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0049 0.0056
Trypanosoma brucei monoglyceride lipase, putative 0.0084 0.251 1
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0017 0.0152 0.0266
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0056 0.1522 0.1732
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0017 0.0152 0.0604
Brugia malayi Amidase family protein 0.0015 0.0087 0.0099
Echinococcus multilocularis histone acetyltransferase MYST2 0.0056 0.1522 0.1732
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0184 0.0209
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.0152 0.0152
Brugia malayi Cytochrome P450 family protein 0.0057 0.155 0.1764
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0015 0.0087 0.0087
Schistosoma mansoni hypothetical protein 0.0018 0.0184 0.0184
Brugia malayi amidase 0.0123 0.3867 0.44
Onchocerca volvulus 0.0028 0.0564 0.1493
Echinococcus granulosus histone acetyltransferase MYST2 0.0056 0.1522 0.1732
Echinococcus multilocularis geminin 0.0179 0.582 0.6623
Schistosoma mansoni hypothetical protein 0.0038 0.0897 0.0897
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0015 0.0087 0.0348
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.251 1
Schistosoma mansoni lamin 0.0028 0.0564 0.0564
Echinococcus granulosus transient receptor potential cation channel 0.0196 0.6408 0.7292
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0015 0.0087 0.5
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0023 0.0356 0.1418
Echinococcus multilocularis lysosomal alpha glucosidase 0.0182 0.592 0.6737
Mycobacterium ulcerans lysophospholipase 0.0084 0.251 1
Onchocerca volvulus 0.0054 0.1449 0.4305
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0015 0.0087 0.0099
Brugia malayi intermediate filament protein 0.0028 0.0564 0.0641
Onchocerca volvulus 0.0049 0.1285 0.3782
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0015 0.0087 0.0099
Echinococcus granulosus ankyrin repeat protein 0.0192 0.6271 0.7137
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0102 0.0116
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0978 0.3661
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0015 0.0094 0.0374
Schistosoma mansoni alpha-glucosidase 0.0157 0.5036 0.5036
Loa Loa (eye worm) hypothetical protein 0.0028 0.0564 0.0641
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0152 0.155
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0084 0.251 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.1352 0.1538
Loa Loa (eye worm) hypothetical protein 0.0056 0.1522 0.1732
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0084 0.251 1
Schistosoma mansoni alpha glucosidase 0.004 0.0978 0.0978
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0152 0.0173
Echinococcus multilocularis musashi 0.0028 0.0564 0.0641
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0184 0.0209
Mycobacterium tuberculosis Possible lysophospholipase 0.0084 0.251 1
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0015 0.0087 0.0348
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.0978 0.3661
Trypanosoma cruzi amidase, putative 0.0015 0.0087 0.0348
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0356 0.0405
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0978 0.3661
Echinococcus multilocularis lamin dm0 0.0028 0.0564 0.0641
Mycobacterium leprae PROBABLE AMIDASE AMIC (AMINOHYDROLASE) 0.0015 0.0087 0.0348
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0184 0.0209
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.1352 0.1538
Echinococcus granulosus fatty acid amide hydrolase 1 0.0123 0.3867 0.44
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.1285 0.1285
Mycobacterium ulcerans amidase 0.0015 0.0087 0.0348
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0015 0.0087 0.0099
Loa Loa (eye worm) cytochrome P450 family protein 0.0057 0.155 0.1764
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0978 0.3661
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.1285 0.1462
Echinococcus multilocularis lysosomal alpha glucosidase 0.0182 0.592 0.6737
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0015 0.0087 0.5
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0356 0.1418
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0152 0.0173
Brugia malayi putative amidase 0.0015 0.0087 0.0099
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0564 0.0641
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0015 0.0087 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0978 0.3661
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.0978 0.3661
Brugia malayi Cytochrome P450 family protein 0.0023 0.0356 0.0405
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0897 0.1021
Brugia malayi mbt repeat family protein 0.0049 0.1285 0.1462
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.1352 0.1538
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.0978 0.3661
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0102 0.0116
Schistosoma mansoni hypothetical protein 0.0179 0.582 0.582
Trypanosoma brucei glycosyl hydrolase-like protein 0.0015 0.0094 0.0374
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0017 0.0152 0.0604
Mycobacterium ulcerans peptide amidase, GatA 0.0015 0.0087 0.0348
Brugia malayi mbt repeat family protein 0.0049 0.1285 0.1462
Loa Loa (eye worm) hypothetical protein 0.0028 0.0545 0.0621
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0356 0.0405
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.0978 0.1113
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0123 0.3867 0.44
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.1285 0.1462
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.1285 0.1285
Schistosoma mansoni myelin transcription factor 1 myt1 0.0056 0.1522 0.1522
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.4222 0.4805
Loa Loa (eye worm) amidase 0.0015 0.0087 0.0099
Onchocerca volvulus 0.0028 0.0564 0.1493
Brugia malayi Cytochrome P450 family protein 0.0023 0.0356 0.0405
Schistosoma mansoni lamin 0.0028 0.0564 0.0564
Trypanosoma cruzi monoglyceride lipase, putative 0.0084 0.251 1
Plasmodium falciparum lysophospholipase, putative 0.0084 0.251 1
Schistosoma mansoni hypothetical protein 0.0179 0.582 0.582
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0015 0.0087 0.0348
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.1352 0.1538
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.0084 0.251 1
Mycobacterium leprae PROBABLE GLUTAMYL-TRNA(GLN) AMIDOTRANSFERASE (SUBUNIT A) GATA (Glu-ADT SUBUNIT A) 0.0015 0.0087 0.0348
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0056 0.1512 0.1721
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0182 0.592 0.6737
Onchocerca volvulus 0.0105 0.3242 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0978 0.3898
Echinococcus granulosus lysosomal alpha glucosidase 0.0182 0.592 0.6737
Echinococcus multilocularis lamin 0.0028 0.0564 0.0641
Leishmania major glycosyl hydrolase-like protein 0.0015 0.0094 0.0374
Loa Loa (eye worm) CYP4Cod1 0.0023 0.0356 0.0405
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0056 0.1522 0.1732
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.1285 0.1462
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0049 0.0056
Trypanosoma brucei glucosidase, putative 0.004 0.0978 0.3898
Brugia malayi isocitrate dehydrogenase 0.0017 0.0152 0.0173
Loa Loa (eye worm) MBCTL1 0.0056 0.1522 0.1732
Echinococcus multilocularis survival motor neuron protein 1 0.0264 0.8788 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0194 0.6331 0.7204
Loa Loa (eye worm) hypothetical protein 0.0013 0.0031 0.0035
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0356 0.1418
Leishmania major monoglyceride lipase, putative 0.0084 0.251 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0978 0.3661
Loa Loa (eye worm) hypothetical protein 0.0264 0.8788 1
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0017 0.0152 0.0266
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.1285 0.1462
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.1285 0.1285
Brugia malayi hypothetical protein 0.0264 0.8788 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0015 0.0094 0.0107
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0056 0.1522 0.1732
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0054 0.1449 0.1649
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.0152 0.0173
Echinococcus granulosus lamin dm0 0.0028 0.0564 0.0641
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0084 0.251 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.251 1
Schistosoma mansoni hypothetical protein 0.0054 0.1449 0.1449
Schistosoma mansoni fatty-acid amide hydrolase 0.0015 0.0087 0.0087
Echinococcus granulosus GPCR family 2 0.0018 0.0184 0.0209
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.0152 0.0173
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.0978 0.3661
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.0152 0.0173
Trypanosoma brucei cytochrome P450, putative 0.0023 0.0356 0.1418
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0017 0.0152 0.0604
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.0978 0.1113
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0015 0.0094 0.0374
Echinococcus granulosus fatty acid amide hydrolase 1 0.0123 0.3867 0.44
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0184 0.0209
Mycobacterium ulcerans amidase 0.0015 0.0087 0.0348
Leishmania major cytochrome p450-like protein 0.0023 0.0356 0.1418
Echinococcus multilocularis transient receptor potential cation channel 0.0196 0.6418 0.7304
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0152 0.0173
Mycobacterium ulcerans amidase 0.0015 0.0087 0.0348
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0152 0.0604
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.1285 0.1462
Loa Loa (eye worm) hypothetical protein 0.0018 0.0184 0.0209
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.1352 0.1352
Schistosoma mansoni fatty-acid amide hydrolase 0.0123 0.3867 0.3867
Brugia malayi Glycosyl hydrolases family 31 protein 0.0182 0.592 0.6737
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0015 0.0087 0.0348
Plasmodium falciparum lysophospholipase, putative 0.0084 0.251 1
Schistosoma mansoni alpha-glucosidase 0.0157 0.5036 0.5036
Brugia malayi Isocitrate dehydrogenase 0.0017 0.0152 0.0173
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.0978 0.3661
Plasmodium vivax PST-A protein 0.0084 0.251 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.251 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.251 1
Schistosoma mansoni transient receptor potential cation channel subfamily A member 0.0192 0.6271 0.6271
Loa Loa (eye worm) hypothetical protein 0.0123 0.3867 0.44
Schistosoma mansoni hypothetical protein 0.0018 0.0184 0.0184
Brugia malayi Amidase family protein 0.0015 0.0087 0.0099
Echinococcus granulosus geminin 0.0179 0.582 0.6623
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0152 0.0604
Trypanosoma cruzi amidase, putative 0.0015 0.0087 0.0348
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.0978 0.3661
Plasmodium falciparum lysophospholipase, putative 0.0084 0.251 1
Leishmania major hypothetical protein, conserved 0.0015 0.0087 0.0348
Brugia malayi Calcitonin receptor-like protein seb-1 0.0056 0.1512 0.1721
Leishmania major alpha glucosidase II subunit, putative 0.004 0.0978 0.3898
Echinococcus multilocularis ankyrin repeat protein 0.0192 0.6271 0.7137
Loa Loa (eye worm) hypothetical protein 0.0013 0.0031 0.0035
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.0152 0.0173
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.1352 0.1352
Schistosoma mansoni hypothetical protein 0.0018 0.0184 0.0184
Loa Loa (eye worm) hypothetical protein 0.0038 0.0897 0.1021
Schistosoma mansoni hypothetical protein 0.0018 0.0184 0.0184
Echinococcus granulosus lamin 0.0028 0.0564 0.0641
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0564 0.0641
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0184 0.0209
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0049 0.1285 0.3782
Brugia malayi MH2 domain containing protein 0.0133 0.4222 0.4805
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.1352 0.1352
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0015 0.0087 0.0348
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.251 1
Schistosoma mansoni amidase 0.0123 0.3867 0.3867
Loa Loa (eye worm) hypothetical protein 0.0049 0.1285 0.1462
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0123 0.3867 0.44
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.0978 0.1113
Echinococcus granulosus survival motor neuron protein 1 0.0264 0.8788 1
Schistosoma mansoni survival motor neuron protein 0.0054 0.1449 0.1449
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0056 0.1512 0.1721
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0978 0.3898
Plasmodium falciparum esterase, putative 0.0084 0.251 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.1352 0.1538
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0015 0.0087 0.0348
Loa Loa (eye worm) hypothetical protein 0.0056 0.1512 0.1721
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0152 0.155
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0184 0.0209
Mycobacterium ulcerans hypothetical protein 0.0084 0.251 1
Mycobacterium ulcerans amidase 0.0015 0.0087 0.0348
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.251 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0194 0.6331 0.7204
Trypanosoma brucei monoglyceride lipase, putative 0.0084 0.251 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0094 0.0107
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.0978 0.1113
Echinococcus granulosus intermediate filament protein 0.0028 0.0564 0.0641
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0184 0.0209
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0015 0.0087 0.0348
Echinococcus granulosus fatty acid amide hydrolase 1 0.0015 0.0087 0.0099

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) = 2.5 uM Agonist activity at human TRPV1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric analysis ChEMBL. 23474898
EC50 (binding) = 13.5 uM Agonist activity at rat TRPA1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric analysis ChEMBL. 23474898
Efficacy (binding) = 34.1 % Agonist activity at human TRPV1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric analysis relative to ionomycin ChEMBL. 23474898
Efficacy (binding) = 53.9 % Agonist activity at rat TRPA1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric analysis relative to allyl isothiocyanate ChEMBL. 23474898
IC50 (binding) = 86.7 nM Inhibition of FAAH in rat brain membranes assessed as [14C]AEA hydrolysis to [14C]Ethanolamine after 30 mins by scintillation counting analysis ChEMBL. 23474898
IC50 (binding) > 1000 nM Inhibition of MAGL (unknown origin) expressed in African green monkey COS7 cell cytosolic fraction assessed as [3H]2-AG hydrolysis to [3H]arachidonic acid after 20 mins by beta counting analysis ChEMBL. 23474898
IC50 (binding) = 7.6 uM Antagonist activity at human TRPV1 receptor expressed in HEK293 cells assessed as inhibition of capsaicin-induced intracellular Ca2+ elevation incubated for 5 mins prior to capsaicin-stimulation by spectrofluorimetric analysis ChEMBL. 23474898
IC50 (binding) = 15 uM Antagonist activity at rat TRPA1 receptor expressed in HEK293 cells assessed as inhibition of allyl isothiocyanate-induced intracellular Ca2+ elevation incubated for 5 mins prior to allyl isothiocyanate-stimulation by spectrofluorimetric analysis ChEMBL. 23474898

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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