Detailed information for compound 280311

Basic information

Technical information
  • TDR Targets ID: 280311
  • Name: 1-[2-[4-[(4-chlorophenyl)methyl]phenoxy]ethyl ]pyrrolidine
  • MW: 315.837 | Formula: C19H22ClNO
  • H donors: 0 H acceptors: 0 LogP: 4.97 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)Cc1ccc(cc1)OCCN1CCCC1
  • InChi: 1S/C19H22ClNO/c20-18-7-3-16(4-8-18)15-17-5-9-19(10-6-17)22-14-13-21-11-1-2-12-21/h3-10H,1-2,11-15H2
  • InChiKey: RXNBBYQSDGMDAU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[2-[4-(4-chlorobenzyl)phenoxy]ethyl]pyrrolidine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens leukotriene A4 hydrolase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum ko:K01254 leukotriene-A4 hydrolase [EC3.3.2.6], putative Get druggable targets OG5_129538 All targets in OG5_129538
Echinococcus multilocularis leukotriene A 4 hydrolase Get druggable targets OG5_129538 All targets in OG5_129538
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) Get druggable targets OG5_129538 All targets in OG5_129538
Echinococcus granulosus leukotriene A 4 hydrolase Get druggable targets OG5_129538 All targets in OG5_129538
Loa Loa (eye worm) leukotriene A4 hydrolase Get druggable targets OG5_129538 All targets in OG5_129538
Candida albicans leukotriene A4 hydrolase/leucyl aminopeptidase Get druggable targets OG5_129538 All targets in OG5_129538
Candida albicans leukotriene A4 hydrolase/leucyl aminopeptidase Get druggable targets OG5_129538 All targets in OG5_129538
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 leukotriene A4 hydrolase 611 aa 508 aa 22.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) peptidase family M1 containing protein 0.0015 0.0063 0.0172
Echinococcus multilocularis cathepsin L cysteine protease 0.0015 0.0069 0.0054
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0057 0.0639 0.0625
Mycobacterium tuberculosis Probable hydrolase 0.0108 0.1344 0.1425
Trichomonas vaginalis ap endonuclease, putative 0.0056 0.0628 0.4673
Onchocerca volvulus 0.0044 0.0458 0.3411
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0391
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Brugia malayi LBP/BPI 0.0044 0.0458 0.2827
Entamoeba histolytica cysteine proteinase, putative 0.0015 0.0069 0.1102
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Onchocerca volvulus 0.0015 0.0063 0.0472
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Brugia malayi hypothetical protein 0.0059 0.0664 0.4095
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Trichomonas vaginalis sphingomyelinase C 2 precursor, putative 0.0011 0.0015 0.0111
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0059 0.0664 0.4095
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0108 0.1344 0.1425
Trichomonas vaginalis conserved hypothetical protein 0.0044 0.0458 0.3411
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0015 0.0069 0.0515
Onchocerca volvulus Cathepsin F homolog 0.0015 0.0069 0.0515
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0365
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0062 0.0714 0.5313
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0024 0.0188 0.0207
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0015 0.0063 0.0365
Echinococcus granulosus beta LACTamase domain containing family member 0.0108 0.1344 0.1479
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0093 0.1141 0.1255
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Onchocerca volvulus 0.0108 0.1344 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0053 0.0592 0.9233
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Leishmania major cathepsin L-like protease 0.0058 0.0658 0.4836
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.004
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Onchocerca volvulus 0.0059 0.0664 0.494
Schistosoma mansoni lipoxygenase 0.0057 0.064 0.0704
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0627 0.4401
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Brugia malayi hypothetical protein 0.0034 0.0332 0.2051
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0015 0.0069 0.0054
Loa Loa (eye worm) hypothetical protein 0.0057 0.064 0.1734
Trypanosoma cruzi cysteine peptidase, putative 0.0058 0.0658 0.4836
Trichomonas vaginalis type IV inositol 5-phosphatase, putative 0.0011 0.0015 0.0111
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0172
Trichomonas vaginalis D-aminoacylase, putative 0.0108 0.1344 1
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Schistosoma mansoni hypothetical protein 0.0011 0.0015 0.0016
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0489 0.0538
Onchocerca volvulus Cathepsin L homolog 0.0015 0.0069 0.0515
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0053 0.0588 0.4315
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0159 0.2044 0.2032
Echinococcus multilocularis dnaJ subfamily B 0.0441 0.5916 0.591
Echinococcus granulosus geminin 0.017 0.219 0.241
Toxoplasma gondii aldehyde dehydrogenase 0.0057 0.0639 0.4553
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0056 0.0627 0.4605
Mycobacterium tuberculosis Probable esterase LipL 0.0108 0.1344 0.1425
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Brugia malayi Doublecortin family protein 0.0057 0.064 0.3947
Toxoplasma gondii aminopeptidase n, putative 0.0015 0.0063 0.0353
Plasmodium falciparum cysteine proteinase falcipain 3 0.0015 0.0069 0.0869
Loa Loa (eye worm) hypothetical protein 0.0059 0.0664 0.1799
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0015 0.0069 0.0188
Entamoeba histolytica sphingomyelinase C precursor, putative 0.0011 0.0015 0.0238
Onchocerca volvulus 0.0108 0.1344 1
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0159 0.2044 0.2249
Plasmodium vivax multidomain scavenger receptor, putative 0.0057 0.064 0.4703
Toxoplasma gondii aminopeptidase N, putative 0.0015 0.0063 0.0353
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0365
Brugia malayi beta-lactamase 0.0108 0.1344 0.8289
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Trypanosoma cruzi major cysteine proteinase, putative 0.0046 0.0487 0.3551
Trichomonas vaginalis penicillin-binding protein, putative 0.0108 0.1344 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0013 0.0041 0.0045
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0093 0.1141 0.1127
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Trypanosoma brucei Aminopeptidase M1, putative 0.0015 0.0063 0.0365
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.0639 0.4498
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Echinococcus granulosus cathepsin l1 0.0015 0.0069 0.0076
Schistosoma mansoni hypothetical protein 0.0024 0.0188 0.0207
Loa Loa (eye worm) hypothetical protein 0.0059 0.0664 0.1799
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0365
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0056 0.0628 0.1702
Mycobacterium ulcerans esterase/lipase LipP 0.0108 0.1344 1
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0015 0.004
Echinococcus multilocularis beta LACTamase domain containing family member 0.0108 0.1344 0.1331
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0056 0.0628 0.5
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0056 0.0628 0.0614
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0472
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0172
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0015 0.0069 0.0188
Schistosoma mansoni rab6-interacting 0.0057 0.064 0.0704
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0472
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0049
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0093 0.1141 0.1255
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Toxoplasma gondii cathepsin CPL 0.0015 0.0069 0.0396
Echinococcus granulosus synaptojanin 1 0.0011 0.0015 0.0016
Brugia malayi TATA binding protein associated factor 0.0015 0.0063 0.0391
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0015 0.004
Brugia malayi hypothetical protein 0.0059 0.0664 0.4095
Onchocerca volvulus 0.0015 0.0069 0.0515
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0062 0.0714 0.0786
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0489 0.1325
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Plasmodium vivax ataxin-2 like protein, putative 0.0053 0.0592 0.4342
Loa Loa (eye worm) CXXC zinc finger family protein 0.0059 0.0666 0.1803
Echinococcus granulosus mixed lineage leukemia protein mll 0.0015 0.006 0.0066
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Mycobacterium ulcerans lipase LipD 0.0108 0.1344 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0056 0.0627 0.0656
Loa Loa (eye worm) CCR4-NOT transcription complex subunit 6 family protein 0.0011 0.0015 0.004
Trichomonas vaginalis D-aminoacylase, putative 0.0108 0.1344 1
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0102 0.1262 0.7786
Onchocerca volvulus 0.0015 0.0069 0.0515
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0015 0.004
Echinococcus granulosus traf and tnf receptor associated protein 0.0011 0.0015 0.0016
Trypanosoma cruzi cysteine peptidase, putative 0.0058 0.0658 0.4836
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0279 0.3691 0.3681
Trichomonas vaginalis penicillin-binding protein, putative 0.0108 0.1344 1
Loa Loa (eye worm) fibroinase 0.0015 0.0069 0.0188
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0015 0.0063 0.007
Loa Loa (eye worm) hypothetical protein 0.0044 0.0458 0.1242
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0015 0.0063 0.0775
Mycobacterium tuberculosis Conserved protein 0.0108 0.1344 0.1425
Brugia malayi beta-lactamase family protein 0.0108 0.1344 0.8289
Loa Loa (eye worm) hypothetical protein 0.0044 0.0458 0.1242
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0172
Entamoeba histolytica cysteine proteinase, putative 0.0015 0.0069 0.1102
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0062 0.0714 0.0786
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0102 0.1262 0.342
Echinococcus granulosus RUN 0.0057 0.064 0.0704
Schistosoma mansoni cathepsin F (C01 family) 0.0015 0.0069 0.0076
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0056 0.0628 0.4614
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0365
Schistosoma mansoni ap endonuclease 0.0056 0.0628 0.0691
Leishmania major cathepsin L-like protease 0.0015 0.0069 0.0409
Schistosoma mansoni nocturnin 0.0011 0.0015 0.0016
Echinococcus granulosus neutral sphingomyelinase 0.0011 0.0015 0.0016
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Schistosoma mansoni carbon catabolite repressor protein 0.0011 0.0015 0.0016
Plasmodium falciparum ataxin-2 like protein, putative 0.0053 0.0592 0.9233
Schistosoma mansoni aldehyde dehydrogenase 0.0057 0.0639 0.0704
Schistosoma mansoni rab6-interacting 0.0057 0.064 0.0704
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0015 0.0063 0.0365
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0093 0.1141 0.1255
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Echinococcus granulosus leukotriene A 4 hydrolase 0.0279 0.3691 0.4062
Onchocerca volvulus 0.0015 0.0063 0.0472
Trypanosoma brucei PAB1-binding protein , putative 0.0053 0.0592 0.4342
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0013 0.0042 0.0315
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0015 0.0069 0.0054
Onchocerca volvulus Putative neutral sphingomyelinase 0.0011 0.0015 0.0111
Schistosoma mansoni hypothetical protein 0.0057 0.064 0.0704
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0365
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Loa Loa (eye worm) hypothetical protein 0.0044 0.0458 0.1242
Toxoplasma gondii histone lysine methyltransferase SET1 0.0111 0.1386 1
Toxoplasma gondii Alpha-galactosidase 0.0013 0.0041 0.0191
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Brugia malayi hypothetical protein 0.0044 0.0458 0.2827
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Entamoeba histolytica aminopeptidase, putative 0.0015 0.0063 0.1009
Onchocerca volvulus 0.0015 0.0069 0.0515
Onchocerca volvulus 0.0015 0.0069 0.0515
Entamoeba histolytica inositol polyphosphate-5-phosphatase, putative 0.0011 0.0015 0.0238
Mycobacterium ulcerans hypothetical protein 0.0108 0.1344 1
Leishmania major cathepsin L-like protease 0.0015 0.0069 0.0409
Trypanosoma cruzi hypothetical protein, conserved 0.0108 0.1344 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0056 0.0628 0.4614
Schistosoma mansoni hypothetical protein 0.017 0.219 0.241
Leishmania major cathepsin L-like protease 0.0058 0.0658 0.4836
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0015 0.0238
Loa Loa (eye worm) hypothetical protein 0.0059 0.0664 0.1799
Trichomonas vaginalis ocrl type II inositol 5-phosphatase, putative 0.0011 0.0015 0.0111
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.1456 0.3945
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0059 0.0664 0.4095
Leishmania major cathepsin L-like protease 0.0015 0.0069 0.0409
Toxoplasma gondii melibiase subfamily protein 0.0093 0.1141 0.8209
Leishmania major hypothetical protein, conserved 0.0053 0.0592 0.4342
Echinococcus multilocularis microtubule associated protein 2 0.0672 0.9087 0.9086
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0489 0.0538
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0108 0.1344 0.8289
Trichomonas vaginalis skeletal muscle/kidney enriched inositol 5-phosphatase, putative 0.0011 0.0015 0.0111
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.004
Echinococcus granulosus aminopeptidase N 0.0015 0.0063 0.007
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Onchocerca volvulus 0.0102 0.1262 0.9394
Onchocerca volvulus 0.0015 0.0069 0.0515
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0015 0.006 0.0066
Schistosoma mansoni lipoxygenase 0.0159 0.2044 0.2249
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0018 0.0109 0.0094
Toxoplasma gondii exonuclease III APE 0.0056 0.0628 0.447
Echinococcus multilocularis RUN 0.0057 0.064 0.0626
Toxoplasma gondii LsmAD domain-containing protein 0.0053 0.0592 0.4208
Entamoeba histolytica inositol polyphosphate 5-phosphatase, putative 0.0011 0.0015 0.0238
Mycobacterium tuberculosis Conserved protein 0.0108 0.1344 0.1425
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Mycobacterium leprae conserved hypothetical protein 0.0108 0.1344 0.5
Echinococcus multilocularis cysteine protease 0.0015 0.0069 0.0054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0018 0.0109 0.012
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0052 0.0575 0.1559
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0627 0.4401
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0124 0.1569 0.1727
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0011 0.0015 0.0111
Onchocerca volvulus Cathepsin L homolog 0.0015 0.0069 0.0515
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Trypanosoma cruzi cysteine peptidase, putative 0.0058 0.0658 0.4836
Echinococcus granulosus inositol polyphosphate 5 phosphatase OCRL 1 0.0011 0.0015 0.0016
Brugia malayi CXXC zinc finger family protein 0.0059 0.0666 0.4106
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0059 0.0664 0.1799
Brugia malayi hypothetical protein 0.0015 0.0063 0.0391
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0015 0.0063 0.0365
Brugia malayi hypothetical protein 0.0128 0.1621 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Trypanosoma cruzi aminopeptidase, putative 0.0015 0.0063 0.0365
Brugia malayi hypothetical protein 0.0015 0.0063 0.0391
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0059 0.0664 0.4095
Brugia malayi exodeoxyribonuclease III family protein 0.0056 0.0628 0.3874
Mycobacterium tuberculosis Possible penicillin-binding protein 0.069 0.9341 1
Echinococcus granulosus cathepsin L cysteine proteinase 0.0015 0.0069 0.0076
Onchocerca volvulus 0.0015 0.0069 0.0515
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0391
Loa Loa (eye worm) hypothetical protein 0.0057 0.064 0.1734
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Leishmania major cathepsin L-like protease 0.0015 0.0069 0.0409
Trichomonas vaginalis Phospholipase C precursor, putative 0.0011 0.0015 0.0111
Loa Loa (eye worm) hypothetical protein 0.0059 0.0664 0.1799
Trypanosoma cruzi cysteine peptidase, putative 0.0015 0.0069 0.0409
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0056 0.0628 0.4614
Trypanosoma cruzi hypothetical protein, conserved 0.0108 0.1344 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0056 0.0628 1
Onchocerca volvulus 0.0059 0.0666 0.4953
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0056 0.0628 0.4614
Echinococcus multilocularis cysteine protease 0.0015 0.0069 0.0054
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0108 0.1344 0.1479
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0056 0.0628 0.981
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0489 0.0538
Loa Loa (eye worm) cysteine protease 0.0015 0.0069 0.0188
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0049
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Onchocerca volvulus 0.0108 0.1344 1
Onchocerca volvulus 0.0015 0.0069 0.0515
Leishmania major hypothetical protein, conserved 0.0108 0.1344 1
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0015 0.0063 0.007
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Echinococcus multilocularis lipoxygenase domain containing protein 0.0057 0.064 0.0626
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0775
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0011 0.0015 0.0111
Brugia malayi CCR4 0.0011 0.0015 0.0092
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0015 0.0063 0.0049
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0015 0.004
Schistosoma mansoni cpg binding protein 0.0059 0.0666 0.0732
Trypanosoma cruzi cruzipain precursor, putative 0.0058 0.0658 0.4836
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0015 0.0069 0.0515
Loa Loa (eye worm) beta-lactamase 0.0108 0.1344 0.3641
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0015 0.0069 0.0869
Onchocerca volvulus 0.0102 0.1262 0.9394
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Plasmodium vivax vivapain-2 0.0015 0.0069 0.0409
Onchocerca volvulus 0.0102 0.1262 0.9394
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Toxoplasma gondii aminopeptidase N protein 0.0015 0.0063 0.0353
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Onchocerca volvulus 0.0102 0.1262 0.9394
Loa Loa (eye worm) hypothetical protein 0.0059 0.0664 0.1799
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0489 0.0538
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0011 0.0015 0.0016
Brugia malayi F/Y-rich N-terminus family protein 0.0018 0.0106 0.0653
Toxoplasma gondii ABC1 family protein 0.0108 0.1344 0.969
Mycobacterium tuberculosis Conserved protein 0.0108 0.1344 0.1425
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0015 0.0063 0.0365
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Schistosoma mansoni microtubule-associated protein tau 0.0672 0.9087 1
Onchocerca volvulus 0.0057 0.064 0.4762
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0108 0.1344 0.3641
Trichomonas vaginalis ap endonuclease, putative 0.0056 0.0628 0.4673
Schistosoma mansoni aldehyde dehydrogenase 0.0057 0.0639 0.0704
Schistosoma mansoni cathepsin F (C01 family) 0.0015 0.0069 0.0076
Trichomonas vaginalis carbon catabolite repressor protein, putative 0.0011 0.0015 0.0111
Schistosoma mansoni cpg binding protein 0.0062 0.0712 0.0783
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0627 0.069
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0056 0.0628 0.4614
Trypanosoma brucei Aminopeptidase M1, putative 0.0015 0.0063 0.0365
Plasmodium falciparum LCCL domain-containing protein 0.0057 0.064 1
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0627 0.0613
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0108 0.1344 0.1425
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0056 0.0628 0.0657
Schistosoma mansoni hypothetical protein 0.0441 0.5916 0.6511
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0489 0.0475
Brugia malayi LBP / BPI / CETP family, C-terminal domain containing protein 0.0102 0.1262 0.7786
Schistosoma mansoni ap endonuclease 0.0056 0.0628 0.0691
Onchocerca volvulus 0.0057 0.064 0.4762
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0056 0.0627 0.069
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0015 0.0063 0.0365
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Echinococcus multilocularis geminin 0.017 0.219 0.2178
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0049
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0279 0.3691 0.4062
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Brugia malayi hypothetical protein 0.0057 0.064 0.3947
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0056 0.0627 0.3867
Onchocerca volvulus 0.0102 0.1262 0.9394
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.1456 0.3945
Echinococcus multilocularis Polycystic kidney disease protein 0.0057 0.064 0.0626
Loa Loa (eye worm) hypothetical protein 0.0044 0.0458 0.1242
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Schistosoma mansoni polycystin 1-related 0.0057 0.064 0.0704
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.0639 0.4498
Trichomonas vaginalis type II inositol 5-phosphatase, putative 0.0011 0.0015 0.0111
Loa Loa (eye worm) hypothetical protein 0.0015 0.0069 0.0188
Trypanosoma brucei aminopeptidase, putative 0.0015 0.0063 0.0365
Schistosoma mansoni synaptojanin 0.0011 0.0015 0.0016
Schistosoma mansoni cript-related 0.0011 0.0015 0.0016
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Leishmania major cathepsin L-like protease 0.0015 0.0069 0.0409
Echinococcus multilocularis cpg binding protein 0.0062 0.0712 0.0698
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0093 0.1141 0.1255
Loa Loa (eye worm) LBP/BPI/CETP family domain-containing protein 0.0059 0.0664 0.1799
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0057 0.0639 0.0704
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0365
Mycobacterium leprae Probable lipase LipE 0.0108 0.1344 0.5
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0049
Plasmodium vivax vivapain-2 0.0015 0.0069 0.0409
Echinococcus granulosus lipoxygenase domain containing protein 0.0057 0.064 0.0704
Loa Loa (eye worm) TATA binding protein associated factor 0.0015 0.0063 0.0172
Onchocerca volvulus 0.0102 0.1262 0.9394
Echinococcus granulosus lipoxygenase domain containing protein 0.0057 0.064 0.0704
Entamoeba histolytica cysteine protease, putative 0.0015 0.0069 0.1102
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0056 0.0628 1
Schistosoma mansoni ocrl type II inositol 5-phosphatase 0.0011 0.0015 0.0016
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0056 0.0628 0.441
Echinococcus multilocularis aminopeptidase N 0.0015 0.0063 0.0049
Trypanosoma cruzi Aminopeptidase M1, putative 0.0015 0.0063 0.0365
Onchocerca volvulus 0.0102 0.1262 0.9394
Schistosoma mansoni cpg binding protein 0.0062 0.0712 0.0783
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0057 0.0639 0.4699
Plasmodium vivax hypothetical protein, conserved 0.0108 0.1344 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0489 0.0475
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0015 0.004
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0015 0.0063 0.0365
Loa Loa (eye worm) hypothetical protein 0.0062 0.0714 0.1934
Schistosoma mansoni aminopeptidase A (M01 family) 0.0015 0.0063 0.007
Echinococcus multilocularis cathepsin L cysteine protease 0.0015 0.0069 0.0054
Echinococcus granulosus Polycystic kidney disease protein 0.0057 0.064 0.0704
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0108 0.1344 0.1425
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0024 0.0188 0.0174
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.007
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0049
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0093 0.1141 0.1255
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0489 0.3016
Echinococcus granulosus microtubule associated protein 2 0.0672 0.9087 1
Echinococcus granulosus CCR4 NOT transcription complex subunit 6 0.0011 0.0015 0.0016
Onchocerca volvulus 0.0011 0.0015 0.0111
Mycobacterium tuberculosis Probable lipase LipD 0.0108 0.1344 0.1425
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0472
Loa Loa (eye worm) hypothetical protein 0.0108 0.1344 0.3641
Brugia malayi Melibiase family protein 0.0062 0.0714 0.4404
Leishmania major cysteine peptidase A (CPA) 0.0015 0.0069 0.0409
Loa Loa (eye worm) ctsf protein 0.0015 0.0069 0.0188
Loa Loa (eye worm) hypothetical protein 0.0102 0.1262 0.342
Schistosoma mansoni neutral sphingomyelinase 0.0011 0.0015 0.0016
Brugia malayi Cathepsin L-like precursor 0.0015 0.0069 0.0427
Schistosoma mansoni synaptojanin 0.0011 0.0015 0.0016
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0015 0.006 0.0045
Trichomonas vaginalis D-aminoacylase, putative 0.0108 0.1344 1
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0015 0.0238
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0015 0.0069 0.0869
Leishmania major cathepsin L-like protease 0.0058 0.0658 0.4836
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0042 0.0315
Brugia malayi beta-lactamase family protein 0.0108 0.1344 0.8289
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Trypanosoma cruzi aminopeptidase, putative 0.0015 0.0063 0.0365
Loa Loa (eye worm) hypothetical protein 0.0053 0.0592 0.1604
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0015 0.0063 0.007
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Trypanosoma brucei hypothetical protein, conserved 0.0108 0.1344 1
Onchocerca volvulus 0.0059 0.0664 0.494
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0489 0.0538
Mycobacterium tuberculosis Probable lipase LipE 0.0108 0.1344 0.1425
Brugia malayi Papain family cysteine protease containing protein 0.0015 0.0069 0.0427
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0108 0.1344 0.1479
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Brugia malayi hypothetical protein 0.0057 0.064 0.3947
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Brugia malayi LBP / BPI / CETP family, N-terminal domain containing protein 0.0102 0.1262 0.7786
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0279 0.3691 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0056 0.0628 1
Onchocerca volvulus 0.0011 0.0015 0.0111
Trypanosoma cruzi PAB1-binding protein , putative 0.0053 0.0592 0.4342
Trichomonas vaginalis helicase, putative 0.0013 0.0042 0.0315
Trichomonas vaginalis esterase, putative 0.0108 0.1344 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0057 0.064 0.0626
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0015 0.0069 0.0515
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0015 0.006 0.0045
Onchocerca volvulus 0.0102 0.1262 0.9394
Mycobacterium ulcerans aldehyde dehydrogenase 0.0057 0.0639 0.4498
Onchocerca volvulus 0.0015 0.0063 0.0472
Mycobacterium ulcerans beta-lactamase 0.0108 0.1344 1
Schistosoma mansoni loxhd1 0.0057 0.064 0.0704
Brugia malayi hypothetical protein 0.0053 0.0592 0.3651
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0015 0.0069 0.0515
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0042 0.0315
Brugia malayi MH2 domain containing protein 0.0116 0.1456 0.8982
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.004
Echinococcus granulosus dnaJ subfamily B 0.0441 0.5916 0.6511
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0108 0.1344 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0015 0.006 0.0066
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0093 0.1141 0.1127
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0015 0.0238
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0391
Loa Loa (eye worm) hypothetical protein 0.0011 0.0015 0.004
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0013 0.0042 0.0315
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0057 0.0639 0.067
Trypanosoma cruzi PAB1-binding protein , putative 0.0053 0.0592 0.4342
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0058 0.0658 0.4836
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0015 0.0092
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0056 0.0628 0.0691
Echinococcus granulosus cpg binding protein 0.0062 0.0712 0.0783
Schistosoma mansoni hypothetical protein 0.017 0.219 0.241
Loa Loa (eye worm) aminopeptidase N 0.0015 0.0063 0.0172
Loa Loa (eye worm) histone methyltransferase 0.0018 0.0109 0.0296
Loa Loa (eye worm) doublecortin family protein 0.0057 0.064 0.1734
Echinococcus granulosus cathepsin l cysteine peptidase 0.0015 0.0069 0.0076

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.06 uM Inhibitory activity was determined against Leukotriene A4 hydrolase ChEMBL. 10691697
IC50 (binding) = 0.06 uM Inhibitory activity was determined against Leukotriene A4 hydrolase ChEMBL. 10691697
IC50 (functional) = 1 uM Inhibitory activity was determined for LTB4 production in human whole blood. ChEMBL. 10691697
IC50 (functional) = 1 uM Inhibitory activity was determined for LTB4 production in human whole blood. ChEMBL. 10691697

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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