Detailed information for compound 214812

Basic information

Technical information
  • TDR Targets ID: 214812
  • Name: [(2R)-2,3-dihydroxypropyl] (5Z,8Z,11Z,14Z)-ic osa-5,8,11,14-tetraenoate
  • MW: 378.545 | Formula: C23H38O4
  • H donors: 2 H acceptors: 3 LogP: 5.32 Rotable bonds: 18
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OC[C@@H](CO)O
  • InChi: 1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-/t22-/m1/s1
  • InChiKey: DCPCOKIYJYGMDN-NZRYSPDRSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid [(2R)-2,3-dihydroxypropyl] ester

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens fatty acid amide hydrolase Starlite/ChEMBL References
Rattus norvegicus Cannabinoid CB2 receptor Starlite/ChEMBL References
Rattus norvegicus Cannabinoid CB1 receptor Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein 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
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 mansoni fatty-acid amide hydrolase Get druggable targets OG5_127783 All targets in OG5_127783
Schistosoma japonicum ko:K01175 fatty acid amide hydrolase [EC:3.1.-.-], putative 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
Echinococcus multilocularis fatty acid amide hydrolase 1 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
Echinococcus granulosus fatty acid amide hydrolase 1 Get druggable targets OG5_127783 All targets in OG5_127783
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
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 Fatty-acid amide hydrolase 1, putative 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
Schistosoma mansoni amidase Get druggable targets OG5_127783 All targets in OG5_127783
Brugia malayi amidase Get druggable targets OG5_127783 All targets in OG5_127783
Candida albicans hypothetical protein Get druggable targets OG5_127783 All targets in OG5_127783
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni opsin-like receptor Cannabinoid CB2 receptor   360 aa 314 aa 22.0 %
Onchocerca volvulus Phospholipase d-related homolog Cannabinoid CB2 receptor   360 aa 309 aa 23.3 %
Onchocerca volvulus Cannabinoid CB2 receptor   360 aa 327 aa 19.6 %
Schistosoma japonicum ko:K04209 neuropeptide Y receptor, invertebrate, putative Cannabinoid CB2 receptor   360 aa 311 aa 20.6 %
Echinococcus granulosus allatostatin A receptor Cannabinoid CB2 receptor   360 aa 363 aa 22.9 %
Loa Loa (eye worm) neuropeptide F receptor Cannabinoid CB2 receptor   360 aa 348 aa 24.7 %
Onchocerca volvulus Cannabinoid CB2 receptor   360 aa 330 aa 20.9 %
Schistosoma mansoni peptide (allatostatin)-like receptor Cannabinoid CB2 receptor   360 aa 323 aa 22.6 %
Schistosoma mansoni biogenic amine (5HT) receptor Cannabinoid CB2 receptor   360 aa 370 aa 23.5 %
Schistosoma japonicum ko:K04135 adrenergic receptor, alpha 1a, putative Cannabinoid CB2 receptor   360 aa 370 aa 23.8 %
Echinococcus granulosus neuropeptide receptor Cannabinoid CB2 receptor   360 aa 337 aa 24.0 %
Echinococcus multilocularis allatostatin A receptor Cannabinoid CB2 receptor   360 aa 342 aa 22.8 %
Echinococcus multilocularis neuropeptide receptor Cannabinoid CB2 receptor   360 aa 299 aa 24.7 %
Leishmania major hypothetical protein, conserved fatty acid amide hydrolase 579 aa 471 aa 26.5 %
Schistosoma japonicum ko:K04134 cholinergic receptor, invertebrate, putative Cannabinoid CB2 receptor   360 aa 360 aa 23.1 %
Onchocerca volvulus Cannabinoid CB2 receptor   360 aa 389 aa 21.1 %
Onchocerca volvulus Cannabinoid CB2 receptor   360 aa 297 aa 21.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.0119 0.0047 0.3141
Mycobacterium ulcerans lipase/esterase LipN 0.0302 0.0149 1
Mycobacterium ulcerans esterase LipO 0.0302 0.0149 1
Trichomonas vaginalis conserved hypothetical protein 0.0302 0.0149 0.9996
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.0027 0.1814
Trichomonas vaginalis Esterase, putative 0.0302 0.0149 0.9996
Trypanosoma cruzi metacaspase 5, putative 0.0052 0.0009 0.059
Brugia malayi hypoxia-induced factor 1 0.0176 0.0079 0.5265
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0137 0.0057 0.0057
Mycobacterium ulcerans lipase LipI 0.0302 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0047 0.0006 0.0006
Echinococcus multilocularis caspase 0.0137 0.0057 0.0057
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0047 0.0006 0.0006
Schistosoma mansoni hypothetical protein 0.0047 0.0006 0.0006
Mycobacterium ulcerans hypothetical protein 0.0084 0.0027 0.1815
Onchocerca volvulus 0.0089 0.003 0.1819
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Brugia malayi Hypothetical tyrosinase-like protein F21C3.2 in chromosome I 0.0089 0.003 0.2004
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.0109 0.0109
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0006 0.0415
Schistosoma mansoni lipoxygenase 0.0114 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0048 0.0007 0.0007
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.003 0.2004
Schistosoma mansoni caspase-3 (C14 family) 0.0137 0.0057 0.0057
Brugia malayi amidase 0.0123 0.0049 0.3277
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0043 0.0004 0.027
Brugia malayi Cell death protein 3 precursor 0.01 0.0036 0.2401
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.1582 0.087 0.087
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0073 0.0021 0.0021
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0043 0.0004 0.027
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0043 0.0004 0.0004
Echinococcus granulosus lysine specific demethylase 5A 0.0061 0.0014 0.0014
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0047 0.0006 0.0006
Schistosoma mansoni fatty-acid amide hydrolase 0.0123 0.0049 0.0049
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.003 0.2004
Loa Loa (eye worm) hypothetical protein 0.0073 0.0021 0.0021
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0137 0.0057 0.0057
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0114 0.0044 0.0044
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Loa Loa (eye worm) ammd protein 0.0302 0.0149 0.0149
Onchocerca volvulus 0.0089 0.003 0.1819
Schistosoma mansoni jumonji/arid domain-containing protein 0.0061 0.0014 0.0014
Trypanosoma cruzi serine peptidase, Clan SC, Family S9D 0.0302 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0004 0.0004
Toxoplasma gondii alpha/beta hydrolase fold domain-containing protein 0.0302 0.0149 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Loa Loa (eye worm) hypothetical protein 0.0089 0.003 0.003
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Loa Loa (eye worm) hypothetical protein 0.0119 0.0047 0.0047
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0047 0.0006 0.0006
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0061 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0231 0.0109 0.0109
Plasmodium falciparum esterase, putative 0.0084 0.0027 1
Echinococcus multilocularis caspase 2 0.01 0.0036 0.0036
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0302 0.0149 0.0149
Loa Loa (eye worm) aryl-acylamidase 0.0302 0.0149 0.0149
Schistosoma mansoni hypothetical protein 0.0102 0.0037 0.0037
Mycobacterium tuberculosis Probable lipase/esterase LipN 0.0302 0.0149 1
Onchocerca volvulus Glucosylceramidase homolog 0.0198 0.0091 0.6007
Trypanosoma brucei metacaspase 0.0052 0.0009 0.059
Loa Loa (eye worm) ShTK domain-containing protein 0.0089 0.003 0.003
Treponema pallidum N-acetylphosphinothricin-tripetide-deacetylase 0.0302 0.0149 0.5
Trypanosoma cruzi metacaspase, putative 0.0052 0.0009 0.059
Loa Loa (eye worm) hypothetical protein 0.0149 0.0064 0.0064
Mycobacterium tuberculosis Probable carboxylesterase LipQ 0.0302 0.0149 1
Echinococcus granulosus caspase 3 apoptosis cysteine peptidase 0.0137 0.0057 0.0057
Brugia malayi ShTK domain containing protein 0.0089 0.003 0.2004
Onchocerca volvulus Huntingtin homolog 0.0119 0.0047 0.2983
Mycobacterium tuberculosis Probable esterase LipO 0.0302 0.0149 1
Trichomonas vaginalis glucosylceramidase, putative 0.0209 0.0097 0.6496
Schistosoma mansoni hypothetical protein 0.0037 0.0001 0.0001
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0052 0.0009 0.059
Entamoeba histolytica hypothetical protein 0.0037 0.0001 0.0227
Mycobacterium tuberculosis Possible lipase LipU 0.0302 0.0149 1
Leishmania major metacaspase, putative 0.0052 0.0009 0.059
Schistosoma mansoni aryl hydrocarbon receptor 0.0057 0.0012 0.0012
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0137 0.0057 0.0057
Mycobacterium ulcerans esterase/lipase 0.0302 0.0149 1
Mycobacterium ulcerans carboxylesterase LipQ 0.0302 0.0149 1
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Brugia malayi hypothetical protein 0.0048 0.0007 0.0456
Schistosoma mansoni caspase-7 (C14 family) 0.0137 0.0057 0.0057
Brugia malayi aryl-acylamidase 0.0302 0.0149 0.9996
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0073 0.0021 0.0021
Echinococcus granulosus acetylcholinesterase 0.0073 0.0021 0.0021
Onchocerca volvulus Huntingtin homolog 0.0119 0.0047 0.2983
Schistosoma mansoni subfamily C14A unassigned peptidase (C14 family) 0.0052 0.0009 0.0009
Onchocerca volvulus Cell death protein 3 homolog 0.01 0.0036 0.2225
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.0027 0.1814
Trichomonas vaginalis Esterase, putative 0.0302 0.0149 0.9996
Mycobacterium ulcerans lipase LipH 0.0302 0.0149 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.0027 0.1814
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0001 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0043 0.0004 0.027
Loa Loa (eye worm) tyrosinase 1 0.0089 0.003 0.003
Trypanosoma cruzi metacaspase 5, putative 0.0052 0.0009 0.059
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0052 0.0009 0.059
Brugia malayi jmjC domain containing protein 0.0061 0.0014 0.0928
Echinococcus granulosus fatty acid amide hydrolase 1 0.0123 0.0049 0.0049
Echinococcus multilocularis caspase 3 0.0085 0.0028 0.0028
Schistosoma mansoni hypothetical protein 0.0047 0.0006 0.0006
Brugia malayi mucosa associated lymphoid tissue lymphoma translocation protein 1 0.0052 0.0009 0.0589
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0137 0.0057 0.0057
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0001 0.0001
Mycobacterium ulcerans lipase LipU 0.0302 0.0149 1
Mycobacterium ulcerans hypothetical protein 0.0302 0.0149 1
Echinococcus multilocularis caspase 3, apoptosis cysteine peptidase 0.0137 0.0057 0.0057
Onchocerca volvulus 0.0047 0.0006 0.0192
Echinococcus multilocularis GPCR, family 2 0.0047 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0052 0.0009 0.0009
Brugia malayi latrophilin 2 splice variant baaae 0.0102 0.0037 0.2478
Leishmania major hypothetical protein, conserved 0.0302 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0007 0.0007
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0149 0.0064 0.4252
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0043 0.0004 0.0004
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Mycobacterium tuberculosis Probable esterase LipC 0.0302 0.0149 1
Echinococcus granulosus ubiquitin specific protease 41 0.0043 0.0004 0.0004
Schistosoma mansoni jumonji/arid domain-containing protein 0.0061 0.0014 0.0014
Leishmania major ecotin, putative 0.0302 0.0149 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Echinococcus multilocularis apoptotic protease activating factor 1 0.0048 0.0007 0.0007
Mycobacterium tuberculosis Probable non lipolytic carboxylesterase NlhH 0.0302 0.0149 1
Trypanosoma brucei metacaspase MCA3 0.0052 0.0009 0.059
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0043 0.0004 0.0004
Schistosoma mansoni tyrosinase precursor 0.0089 0.003 0.003
Echinococcus granulosus caspase 2 0.01 0.0036 0.0036
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0114 0.0044 0.0044
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0043 0.0004 0.027
Brugia malayi Common central domain of tyrosinase family protein 0.0089 0.003 0.2004
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.0027 0.1814
Echinococcus granulosus caspase 3 0.0085 0.0028 0.0028
Loa Loa (eye worm) hypothetical protein 0.01 0.0036 0.0036
Echinococcus granulosus caspase 8 0.0052 0.0009 0.0009
Schistosoma mansoni caspase-7 (C14 family) 0.01 0.0036 0.0036
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0084 0.0027 1
Onchocerca volvulus 0.0302 0.0149 1
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0043 0.0004 0.0004
Schistosoma mansoni single-minded 0.0057 0.0012 0.0012
Trypanosoma cruzi Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0302 0.0149 1
Echinococcus multilocularis hormone sensitive lipase 1.7812 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 0.0049 0.0049
Trypanosoma brucei metacaspase 5, putative 0.0052 0.0009 0.059
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1
Mycobacterium ulcerans putative regulatory protein 0.0042 0.0003 0.0228
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0137 0.0057 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.0027 0.1814
Toxoplasma gondii alpha/beta hydrolase fold domain-containing protein 0.0302 0.0149 1
Schistosoma mansoni hormone-sensitive lipase (S09 family) 1.7812 1 1
Trypanosoma cruzi Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0302 0.0149 1
Trypanosoma brucei monoglyceride lipase, putative 0.0084 0.0027 0.1815
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0043 0.0004 0.027
Brugia malayi hypothetical protein 0.0037 0.0001 0.0041
Schistosoma mansoni survival motor neuron protein 0.0047 0.0006 0.0006
Brugia malayi Carboxylesterase family protein 0.0073 0.0021 0.139
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0137 0.0057 0.0057
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.0027 0.1814
Echinococcus granulosus fatty acid amide hydrolase 1 0.0123 0.0049 0.0049
Onchocerca volvulus 0.0089 0.003 0.1819
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0043 0.0004 0.027
Echinococcus multilocularis transfer RNA-Lys 0.0042 0.0003 0.0003
Brugia malayi Hypothetical tyrosinase-like protein C02C2.1 in chromosome III 0.0089 0.003 0.2004
Mycobacterium ulcerans esterase LipC 0.0302 0.0149 1
Echinococcus multilocularis caspase 8 0.0052 0.0009 0.0009
Schistosoma mansoni hypothetical protein 0.0047 0.0006 0.0006
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0047 0.0006 0.0006
Brugia malayi Carboxylesterase family protein 0.0073 0.0021 0.139
Plasmodium vivax PST-A protein 0.0084 0.0027 1
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0302 0.0149 1
Trypanosoma brucei Metacaspase-4 0.0052 0.0009 0.059
Mycobacterium tuberculosis Possible esterase LipW 0.0302 0.0149 1
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0043 0.0004 0.0004
Entamoeba histolytica hypothetical protein 0.0037 0.0001 0.0227
Echinococcus multilocularis lysine specific demethylase 5A 0.0061 0.0014 0.0014
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0043 0.0004 0.5
Mycobacterium ulcerans membrane-bound esterase LipM 0.0302 0.0149 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0137 0.0057 0.379
Echinococcus granulosus apoptotic protease activating factor 1 0.0048 0.0007 0.0007
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.0014 0.0014
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0061 0.0014 0.0014
Toxoplasma gondii ICE family protease (caspase) p20 domain-containing protein 0.0052 0.0009 0.059
Mycobacterium tuberculosis Putative acetyl hydrolase MbtJ 0.0302 0.0149 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0084 0.0027 0.1814
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0043 0.0004 0.027
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Schistosoma mansoni hormone-sensitive lipase (S09 family) 1.7812 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Trypanosoma brucei monoglyceride lipase, putative 0.0084 0.0027 0.1815
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0036 0 0.5
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Entamoeba histolytica hypothetical protein 0.0037 0.0001 0.0227
Trichomonas vaginalis valacyclovir hydrolase, putative 0.0084 0.0027 0.1814
Echinococcus granulosus carboxylesterase 5A 0.0073 0.0021 0.0021
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1
Trypanosoma cruzi metacaspase, putative 0.0052 0.0009 0.059
Brugia malayi PAS domain containing protein 0.0057 0.0012 0.0783
Mycobacterium ulcerans lysophospholipase 0.0084 0.0027 0.1815
Trypanosoma cruzi Alpha/beta hydrolase domain-containing protein 0.0302 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0191 0.0087 0.0087
Mycobacterium ulcerans esterase LipW 0.0302 0.0149 1
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0004 0.027
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0123 0.0049 0.0049
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0043 0.0004 0.149
Schistosoma mansoni hypothetical protein 0.0047 0.0006 0.0006
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Brugia malayi bHLH-PAS transcription factor 0.0042 0.0003 0.0227
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0123 0.0049 0.0049
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0047 0.0006 0.0419
Mycobacterium tuberculosis Probable acetyl-hydrolase/esterase LipR 0.0302 0.0149 1
Loa Loa (eye worm) hypoxia-induced factor 1 0.0176 0.0079 0.0079
Schistosoma mansoni jumonji domain containing protein 0.0061 0.0014 0.0014
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.0109 0.0109
Trichomonas vaginalis Esterase, putative 0.0302 0.0149 0.9996
Schistosoma mansoni tyrosinase precursor 0.0089 0.003 0.003
Trypanosoma cruzi metacaspase, putative 0.0052 0.0009 0.059
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Onchocerca volvulus 0.0048 0.0007 0.0234
Trichomonas vaginalis glucosylceramidase, putative 0.0198 0.0091 0.6095
Schistosoma mansoni hypothetical protein 0.0047 0.0006 0.0006
Echinococcus granulosus GPCR family 2 0.0047 0.0006 0.0006
Loa Loa (eye worm) acetylcholinesterase 1 0.0073 0.0021 0.0021
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0149 0.0064 0.0064
Echinococcus multilocularis ubiquitin specific protease 41 0.0043 0.0004 0.0004
Plasmodium falciparum lysophospholipase, putative 0.0084 0.0027 1
Schistosoma mansoni amidase 0.0123 0.0049 0.0049
Echinococcus multilocularis carboxylesterase 5A 0.0073 0.0021 0.0021
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0043 0.0004 0.0004
Loa Loa (eye worm) carboxylesterase 0.0073 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 0.0119 0.0047 0.0047
Brugia malayi hypothetical protein 0.0191 0.0087 0.5821
Echinococcus multilocularis acetylcholinesterase 0.0073 0.0021 0.0021
Mycobacterium tuberculosis Probable esterase LipM 0.0302 0.0149 1
Mycobacterium tuberculosis Probable esterase/lipase LipF 0.0302 0.0149 1
Schistosoma mansoni lipoxygenase 0.008 0.0025 0.0025
Trichomonas vaginalis Clan CD, family C14, metacaspase-like cysteine peptidase 0.0052 0.0009 0.0589
Loa Loa (eye worm) hypothetical protein 0.0102 0.0037 0.0037
Loa Loa (eye worm) ShTK domain-containing protein 0.0089 0.003 0.003
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0137 0.0057 0.0057
Brugia malayi Latrophilin receptor protein 2 0.0047 0.0006 0.0419
Trypanosoma brucei Isoprenylcysteine alpha-carbonyl methylesterase, putative 0.0302 0.0149 1
Echinococcus multilocularis acetylcholinesterase 0.0073 0.0021 0.0021
Echinococcus granulosus acetylcholinesterase 0.0073 0.0021 0.0021
Loa Loa (eye worm) hypothetical protein 1.7812 1 1
Mycobacterium tuberculosis Probable lipase LipH 0.0302 0.0149 1
Plasmodium falciparum lysophospholipase, putative 0.0084 0.0027 1
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0302 0.0149 0.0149
Loa Loa (eye worm) latrophilin receptor protein 2 0.0047 0.0006 0.0006
Mycobacterium ulcerans lipase LipU 0.0302 0.0149 1
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Leishmania major monoglyceride lipase, putative 0.0084 0.0027 0.1815
Trypanosoma cruzi metacaspase, putative 0.0052 0.0009 0.059
Echinococcus granulosus caspase 0.0137 0.0057 0.0057
Onchocerca volvulus 0.0089 0.003 0.1819
Trypanosoma cruzi monoglyceride lipase, putative 0.0084 0.0027 0.1815
Trypanosoma brucei metacaspase MCA2 0.0052 0.0009 0.059
Mycobacterium leprae Possible lipase LipU 0.0302 0.0149 1
Mycobacterium ulcerans acetyl hydrolase MbtJ 0.0302 0.0149 1
Brugia malayi hypothetical protein 0.0231 0.0109 0.7324
Brugia malayi Calcitonin receptor-like protein seb-1 0.0149 0.0064 0.4252
Trichomonas vaginalis glucosylceramidase, putative 0.0209 0.0097 0.6496
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0137 0.0057 0.0057
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.0084 0.0027 1
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1
Loa Loa (eye worm) hypothetical protein 0.0089 0.003 0.003
Entamoeba histolytica hypothetical protein 0.0037 0.0001 0.0227
Echinococcus granulosus single minded 2 0.0042 0.0003 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0052 0.0009 0.0589
Plasmodium falciparum lysophospholipase, putative 0.0084 0.0027 1
Schistosoma mansoni hormone-sensitive lipase (S09 family) 1.7812 1 1
Brugia malayi jmjC domain containing protein 0.0061 0.0014 0.0928
Trichomonas vaginalis glucosylceramidase, putative 0.0302 0.0149 1

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) > 1000 nM Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF ChEMBL. 12166944
Ki (binding) > 1000 nM Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF ChEMBL. 12166944
Ki (binding) > 1000 nM Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 1 in the presence of PMSF ChEMBL. 12166944
Ki (binding) > 1000 nM Displacement of [3H]-CP-55,940 from rat forebrain membrane which expresses Cannabinoid receptor 2 in the presence of PMSF ChEMBL. 12166944
Ki (binding) = 2.5 uM Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc ChEMBL. 12166944
Ki (binding) = 2.5 uM Inhibition of Fatty-acid amide hydrolase (FAAH) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-25 uM conc ChEMBL. 12166944
Ki (binding) = 10 uM Inhibition of N-arachidonoylethanolamine transporter (AEA) activity in human lymphoma U937 cell using [3H]-AEA as substrate in the 0-1000 nM conc. ChEMBL. 12166944

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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