Detailed information for compound 280281

Basic information

Technical information
  • TDR Targets ID: 280281
  • Name: 2-[4-[4-(2-pyrrolidin-1-ylethoxy)phenoxy]phen yl]-4,5-dihydro-1,3-oxazole
  • MW: 352.427 | Formula: C21H24N2O3
  • H donors: 0 H acceptors: 0 LogP: 3.48 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: C1CCN(C1)CCOc1ccc(cc1)Oc1ccc(cc1)C1=NCCO1
  • InChi: 1S/C21H24N2O3/c1-2-13-23(12-1)14-16-24-18-7-9-20(10-8-18)26-19-5-3-17(4-6-19)21-22-11-15-25-21/h3-10H,1-2,11-16H2
  • InChiKey: OOFLUGQLPZSRDT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-[4-(2-pyrrolidin-1-ylethoxy)phenoxy]phenyl]-4,5-dihydrooxazole
  • 2-[4-[4-[2-(1-pyrrolidinyl)ethoxy]phenoxy]phenyl]-4,5-dihydrooxazole
  • 2-[4-[4-(2-pyrrolidinoethoxy)phenoxy]phenyl]-2-oxazoline
  • 2-[4-[4-(2-1-pyrrolidinylethoxy)phenoxy]phenyl]-4,5-dihydrooxazole

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
Candida albicans leukotriene A4 hydrolase/leucyl aminopeptidase Get druggable targets OG5_129538 All targets in OG5_129538
Schistosoma japonicum ko:K01254 leukotriene-A4 hydrolase [EC3.3.2.6], putative 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
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 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
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
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
Plasmodium falciparum cGMP-dependent protein kinase 0.0011 0.0016 0.0028
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0005 0.0006
Trypanosoma brucei Aminopeptidase M1, putative 0.0015 0.0063 0.0133
Schistosoma mansoni aminopeptidase A (M01 family) 0.0015 0.0063 0.0079
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0073 0.0088
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Schistosoma mansoni nck2/grb4 0.0015 0.0067 0.0084
Schistosoma mansoni hypothetical protein 0.0311 0.367 0.4577
Brugia malayi DKFZp564C0469 protein 0.001 0.0004 0.0002
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0015 0.0064 0.0138
Brugia malayi TATA binding protein associated factor 0.0015 0.0063 0.0061
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Schistosoma mansoni growth factor receptor-bound protein 0.0015 0.0067 0.0084
Schistosoma mansoni microtubule-associated protein tau 0.0669 0.8017 1
Brugia malayi nuclear receptor NHR-88 0.001 0.0005 0.0002
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0063
Plasmodium falciparum glycogen synthase kinase 3 0.0375 0.4438 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0105 0.02
Echinococcus granulosus tyrosine protein kinase Src42A 0.0067 0.0698 0.0868
Brugia malayi Variant SH3 domain containing protein 0.0015 0.0067 0.0065
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0105 0.0227
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0073 0.0073
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0005 0.0002
Plasmodium vivax protein kinase Crk2 0.0296 0.3477 0.7834
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0375 0.4438 0.4436
Toxoplasma gondii aminopeptidase N protein 0.0015 0.0063 0.0133
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0279 0.3274 0.3272
Onchocerca volvulus 0.0375 0.4438 1
Entamoeba histolytica protein kinase domain containing protein 0.0375 0.4438 1
Brugia malayi isocitrate dehydrogenase 0.0016 0.0073 0.0071
Entamoeba histolytica hypothetical protein 0.0036 0.0326 0.0729
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0005 0.0002
Echinococcus multilocularis muscleblind protein 1 0.0145 0.1644 0.1703
Trypanosoma cruzi cdc2-related kinase 3 0.0296 0.3477 0.7834
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0279 0.3274 0.4083
Loa Loa (eye worm) hypothetical protein 0.0832 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0005 0.0002
Echinococcus multilocularis expressed conserved protein 0.0011 0.0016 0.0015
Brugia malayi Muscleblind-like protein 0.0145 0.1644 0.1642
Brugia malayi hypothetical protein 0.0015 0.0063 0.0061
Brugia malayi hypothetical protein 0.0128 0.1442 0.144
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0005 0.0003
Onchocerca volvulus Huntingtin homolog 0.0119 0.1327 0.2987
Trypanosoma cruzi Aminopeptidase M1, putative 0.0015 0.0063 0.0133
Loa Loa (eye worm) hypothetical protein 0.0034 0.0293 0.0291
Echinococcus multilocularis tyrosine protein kinase Blk 0.0069 0.0724 0.0749
Toxoplasma gondii aminopeptidase n, putative 0.0015 0.0063 0.0133
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0005 0.0003
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0063
Loa Loa (eye worm) hypothetical protein 0.0119 0.1327 0.1325
Entamoeba histolytica hypothetical protein 0.0036 0.0326 0.0729
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0073 0.0156
Echinococcus multilocularis muscleblind protein 0.0145 0.1644 0.1703
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.01 0.1093 0.1364
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0375 0.4438 0.4436
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0077 0.0815 0.0843
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0144 0.0142
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0005 0.0006
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0015 0.0063 0.0079
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0005 0.0005
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0005 0.0002
Loa Loa (eye worm) TK protein kinase 0.0069 0.0724 0.0722
Echinococcus granulosus growth factor receptor bound protein 2 0.0015 0.0067 0.0081
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0073 0.0128
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Echinococcus granulosus geminin 0.066 0.7912 0.9869
Echinococcus multilocularis cyclin dependent kinase 1 0.0296 0.3477 0.3606
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0005 0.0006
Entamoeba histolytica cell division protein kinase 2, putative 0.0296 0.3477 0.7835
Loa Loa (eye worm) hypothetical protein 0.0049 0.0483 0.0481
Schistosoma mansoni ap endonuclease 0.0018 0.0105 0.0131
Brugia malayi cell division control protein 2 homolog 0.0296 0.3477 0.3476
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0015 0.0067 0.0084
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0296 0.3477 0.3476
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.01 0.1093 0.1361
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0144 0.0316
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0296 0.3477 0.3476
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0005 0.0002
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0073 0.0156
Echinococcus multilocularis c src tyrosine kinase 0.0017 0.0093 0.0094
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0144 0.0316
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0077 0.0815 0.0843
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0144 0.0316
Echinococcus multilocularis geminin 0.066 0.7912 0.8208
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Loa Loa (eye worm) hypothetical protein 0.0145 0.1644 0.1642
Echinococcus multilocularis replication factor c subunit 1 0.001 0.0004 0.0002
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0005 0.0002
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0073 0.0073
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0375 0.4438 0.4602
Trypanosoma brucei cdc2-related kinase 1 0.0296 0.3477 0.7834
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0144 0.0177
Trypanosoma cruzi aminopeptidase, putative 0.0015 0.0063 0.0133
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0005 0.0002
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0015 0.0063 0.0133
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.01 0.1093 0.1364
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0061
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0133
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0016 0.0073 0.0156
Brugia malayi ecdysteroid receptor 0.001 0.0005 0.0002
Trypanosoma brucei protein kinase, putative 0.0375 0.4438 1
Brugia malayi hypothetical protein 0.0015 0.0063 0.0061
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0005 0.0002
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0005 0.0002
Trypanosoma cruzi cdc2-related kinase 1 0.0296 0.3477 0.7834
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Echinococcus multilocularis cyclin dependent kinase 1 0.0296 0.3477 0.3606
Brugia malayi RNA binding protein 0.0127 0.1424 0.1422
Echinococcus granulosus protein kinase shaggy 0.0375 0.4438 0.5534
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0133
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0483 0.0481
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0171 0.0376
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0175 0.2016 0.4541
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0017 0.0093 0.0094
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0015 0.0067 0.0065
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0073 0.0156
Echinococcus multilocularis protein kinase shaggy 0.0375 0.4438 0.4602
Trichomonas vaginalis replication factor C large subunit, putative 0.001 0.0004 0.00000075442
Schistosoma mansoni hypothetical protein 0.066 0.7912 0.9869
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0105 0.0106
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0005 0.0002
Schistosoma mansoni tar DNA-binding protein 0.0127 0.1424 0.1777
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0238 0.0527
Giardia lamblia Kinase, CMGC GSK 0.0375 0.4438 1
Schistosoma mansoni topbp1 0.001 0.0004 0.0005
Echinococcus multilocularis snurportin 1 0.0311 0.367 0.3806
Plasmodium falciparum protein kinase 5 0.0296 0.3477 0.7834
Entamoeba histolytica Activator 1 140 kDa subunit, putative 0.001 0.0004 0.0004
Toxoplasma gondii ATPase, AAA family protein 0.001 0.0004 0.00000075442
Plasmodium falciparum importin beta, putative 0.0029 0.0238 0.0527
Loa Loa (eye worm) SRC-1 0.0077 0.0815 0.0813
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0015 0.0063 0.0133
Plasmodium vivax glycogen synthase kinase 3, putative 0.0375 0.4438 1
Entamoeba histolytica aminopeptidase, putative 0.0015 0.0063 0.0137
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0077 0.0815 0.0843
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.01 0.1093 0.1091
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0375 0.4438 0.5535
Echinococcus granulosus cyclin dependent kinase 0.0296 0.3477 0.4336
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0105 0.0227
Echinococcus granulosus microtubule associated protein 2 0.0669 0.8017 1
Echinococcus multilocularis NCK adaptor protein 0.0015 0.0067 0.0067
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0005 0.0005
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0073 0.007
Schistosoma mansoni hypothetical protein 0.066 0.7912 0.9869
Loa Loa (eye worm) hypothetical protein 0.0288 0.339 0.3388
Echinococcus granulosus muscleblind protein 0.0145 0.1644 0.2048
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0106
Brugia malayi SRC-1 0.0077 0.0815 0.0813
Entamoeba histolytica hypothetical protein 0.0036 0.0326 0.0729
Brugia malayi Tyrosine-protein kinase abl-1 0.0017 0.0093 0.0091
Trypanosoma cruzi cdc2-related kinase 3 0.0296 0.3477 0.7834
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0011 0.0016 0.0015
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0133
Schistosoma mansoni tyrosine kinase 0.0017 0.0093 0.0116
Brugia malayi Egg laying defective protein 4 0.0011 0.0016 0.0014
Brugia malayi Importin beta-1 subunit 0.0029 0.0238 0.0235
Echinococcus granulosus snurportin 1 0.0311 0.367 0.4576
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0017 0.0093 0.0116
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0326 0.0335
Toxoplasma gondii HEAT repeat-containing protein 0.0029 0.0238 0.0527
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0144 0.0316
Giardia lamblia Kinase, CMGC CDK 0.0296 0.3477 0.7834
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0005 0.0006
Onchocerca volvulus 0.0015 0.0063 0.0137
Onchocerca volvulus 0.001 0.0004 0.0004
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0073 0.0156
Schistosoma mansoni serine/threonine protein kinase 0.0011 0.0016 0.0021
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0017 0.0093 0.0113
Echinococcus multilocularis tyrosine protein kinase Abl 0.0017 0.0093 0.0094
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0375 0.4438 0.5534
Brugia malayi hypothetical protein 0.015 0.1701 0.1699
Loa Loa (eye worm) aminopeptidase N 0.0015 0.0063 0.0061
Schistosoma mansoni serine/threonine protein kinase 0.0011 0.0016 0.0021
Trichomonas vaginalis ran, putative 0.0021 0.0144 0.0316
Toxoplasma gondii aminopeptidase N, putative 0.0015 0.0063 0.0133
Giardia lamblia Kinase, CMGC GSK 0.0375 0.4438 1
Schistosoma mansoni hypothetical protein 0.0016 0.0073 0.0091
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0077 0.0815 0.1014
Schistosoma mansoni tyrosine kinase 0.0077 0.0815 0.1017
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0073 0.007
Onchocerca volvulus 0.0015 0.0063 0.0137
Toxoplasma gondii exonuclease III APE 0.0018 0.0105 0.0227
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0005 0.0002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0005 0.0002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0005 0.0002
Schistosoma mansoni serine/threonine protein kinase 0.0296 0.3477 0.4337
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0005 0.0003
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0105 1
Entamoeba histolytica protein kinase, putative 0.0015 0.0064 0.0138
Schistosoma mansoni thyroid hormone receptor 0.001 0.0005 0.0006
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0105 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0061
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0105 0.0227
Trichomonas vaginalis CMGC family protein kinase 0.0375 0.4438 1
Onchocerca volvulus Huntingtin homolog 0.0119 0.1327 0.2987
Brugia malayi topoisomerase 0.001 0.0004 0.0002
Entamoeba histolytica protein kinase domain containing protein 0.0375 0.4438 1
Echinococcus multilocularis tar DNA binding protein 0.0127 0.1424 0.1476
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0005 0.0002
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0296 0.3477 0.3476
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0005 0.0006
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0015 0.0063 0.0133
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0061
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0375 0.4438 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0067 0.0065
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0005 0.0003
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0144 0.0142
Toxoplasma gondii protein kinase G AGC kinase family member PKG 0.0011 0.0016 0.0028
Schistosoma mansoni hypothetical protein 0.0034 0.0293 0.0365
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0105 0.0101
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0144 0.0147
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.01 0.1093 0.1361
Brugia malayi Pax transcription activation domain interacting protein 0.001 0.0004 0.0002
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0375 0.4438 1
Echinococcus granulosus tar DNA binding protein 0.0127 0.1424 0.1774
Echinococcus granulosus tyrosine protein kinase Lyn 0.0084 0.0902 0.1123
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.01 0.1093 0.1091
Echinococcus multilocularis tyrosine protein kinase Srms 0.0069 0.0724 0.0749
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0004 0.00000075442
Schistosoma mansoni DNA ligase IV 0.001 0.0004 0.0005
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0015 0.0063 0.0133
Brugia malayi hypothetical protein 0.0119 0.1327 0.1325
Chlamydia trachomatis DNA ligase 0.001 0.0004 0.5
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0105 0.0227
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.01 0.1093 0.1132
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0105 1
Schistosoma mansoni topbp1 0.001 0.0004 0.0005
Loa Loa (eye worm) peptidase family M1 containing protein 0.0015 0.0063 0.0061
Leishmania major importin beta-1 subunit, putative 0.0024 0.0171 0.0349
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0133
Schistosoma mansoni tar DNA-binding protein 0.0127 0.1424 0.1777
Schistosoma mansoni adapter molecule crk 0.0015 0.0067 0.0084
Schistosoma mansoni tyrosine kinase 0.001 0.0002 0.0003
Echinococcus granulosus cGMP dependent protein kinase 0.0011 0.0016 0.0018
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Echinococcus granulosus aminopeptidase N 0.0015 0.0063 0.0076
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0326 0.0406
Loa Loa (eye worm) hypothetical protein 0.0016 0.0073 0.007
Trypanosoma brucei malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0327 0.3858 0.8693
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0.0073 0.0156
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0296 0.3477 0.7828
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0073 0.0156
Loa Loa (eye worm) RNA binding protein 0.0127 0.1424 0.1422
Echinococcus granulosus tyrosine kinase 0.0069 0.0724 0.0901
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0293 0.0291
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0015 0.0063 0.0133
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0005 0.0002
Leishmania major GTP-binding protein, putative 0.0021 0.0144 0.0289
Echinococcus multilocularis cGMP dependent protein kinase 1 0.0011 0.0016 0.0015
Echinococcus multilocularis importin subunit beta 1 0.0029 0.0238 0.0244
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0005 0.0002
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0105 0.0227
Echinococcus granulosus tyrosine protein kinase Fyn 0.0077 0.0815 0.1014
Schistosoma mansoni importin beta-1 0.0029 0.0238 0.0296
Brugia malayi Protein kinase domain containing protein 0.0296 0.3477 0.3476
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0311 0.367 0.3668
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0005 0.0002
Brugia malayi hypothetical protein 0.001 0.0004 0.0002
Schistosoma mansoni ap endonuclease 0.0018 0.0105 0.0131
Echinococcus multilocularis cyclin dependent kinase 5 0.0296 0.3477 0.3606
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0005 0.0002
Plasmodium vivax importin-beta 2, putative 0.0029 0.0238 0.0527
Echinococcus granulosus cGMP dependent protein kinase 1 0.0011 0.0016 0.0018
Schistosoma mansoni tar DNA-binding protein 0.0127 0.1424 0.1777
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0067 0.0698 0.0722
Brugia malayi Sex muscle abnormal protein 5 0.0015 0.0067 0.0065
Entamoeba histolytica hypothetical protein 0.0036 0.0326 0.0729
Schistosoma mansoni nuclear hormone receptor 0.001 0.0005 0.0006
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0144 0.0316
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0005 0.0002
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0105 0.0231
Trypanosoma cruzi cdc2-related kinase 1 0.0296 0.3477 0.7834
Echinococcus granulosus tyrosine protein kinase Blk 0.0069 0.0724 0.0901
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Echinococcus granulosus replication factor c subunit 1 0.001 0.0004 0.0002
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0802 0.964 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0005 0.0002
Brugia malayi hypothetical protein 0.0036 0.0326 0.0323
Schistosoma mansoni tyrosine kinase 0.0017 0.0093 0.0116
Trichomonas vaginalis CMGC family protein kinase 0.0296 0.3477 0.7834
Loa Loa (eye worm) hypothetical protein 0.0119 0.1327 0.1325
Echinococcus multilocularis growth factor receptor bound protein 2 0.0015 0.0067 0.0067
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0073 0.0071
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0005 0.0002
Echinococcus granulosus cGMP dependent protein kinase 1 0.0011 0.0016 0.0018
Echinococcus multilocularis microtubule associated protein 2 0.0669 0.8017 0.8317
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0073 0.007
Leishmania major malonyl-coa decarboxylase-like protein 0.0327 0.3858 0.8689
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0005 0.0002
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0171 0.0376
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0015 0.0067 0.0065
Trichomonas vaginalis chromosome transmission fidelity factor, putative 0.001 0.0004 0.00000075442
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0061
Brugia malayi nuclear hormone receptor 0.001 0.0005 0.0002
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0005 0.0006
Loa Loa (eye worm) hypothetical protein 0.0175 0.2016 0.2015
Trypanosoma brucei Aminopeptidase M1, putative 0.0015 0.0063 0.0133
Wolbachia endosymbiont of Brugia malayi malonyl-CoA decarboxylase 0.0832 1 1
Trypanosoma brucei cdc2-related kinase 3 0.0296 0.3477 0.7834
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0073 0.0073
Brugia malayi TAR-binding protein 0.0127 0.1424 0.1422
Loa Loa (eye worm) TK protein kinase 0.0062 0.0631 0.0629
Onchocerca volvulus 0.0015 0.0061 0.0133
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0106
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0005 0.0006
Entamoeba histolytica cell division protein kinase 2, putative 0.0296 0.3477 0.7835
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0105 0.0102
Schistosoma mansoni tyrosine kinase 0.001 0.0002 0.0003
Echinococcus granulosus nibrin 0.001 0.0004 0.0002
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0005 0.0002
Loa Loa (eye worm) hypothetical protein 0.001 0.0005 0.0002
Brugia malayi N-terminal motif family protein 0.0175 0.2016 0.2015
Mycobacterium leprae PROBABLE DNA LIGASE [NAD DEPENDENT] LIGA (POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD+]) 0.001 0.0004 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0005 0.0002
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0073 0.0088
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0015 0.0063 0.0133
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0375 0.4438 1
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0015 0.0063 0.0133
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0063
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.01 0.1093 0.1132
Entamoeba histolytica hypothetical protein 0.0024 0.0171 0.0379
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0077 0.0815 0.0843
Echinococcus multilocularis tyrosine protein kinase HCK 0.0062 0.0631 0.0652
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0077 0.0815 0.0843
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Trypanosoma brucei aminopeptidase, putative 0.0015 0.0063 0.0133
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0483 0.0481
Brugia malayi RNA, U transporter 1 0.0083 0.0892 0.089
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0106
Echinococcus granulosus GPCR family 2 0.0016 0.0073 0.0088
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0105 0.0128
Schistosoma mansoni hypothetical protein 0.0036 0.0326 0.0406
Schistosoma mansoni coup transcription factor 0.001 0.0005 0.0006
Brugia malayi steroid hormone receptor 0.001 0.0005 0.0002
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0063
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0073 0.0071
Brugia malayi hypothetical protein 0.001 0.0004 0.0002
Echinococcus granulosus leukotriene A 4 hydrolase 0.0279 0.3274 0.4081
Schistosoma mansoni serine/threonine protein kinase 0.0296 0.3477 0.4337
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0073 0.0073
Schistosoma mansoni hypothetical protein 0.0016 0.0073 0.0091
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0144 0.0316
Mycobacterium ulcerans aminopeptidase N PepN 0.0015 0.0063 0.5868
Echinococcus granulosus tyrosine protein kinase HCK 0.0062 0.0631 0.0784
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0005 0.0006
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0238 0.0527
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0069 0.0724 0.0749
Brugia malayi Peptidase family M1 containing protein 0.0015 0.0063 0.0061
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0073 0.0073
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0015 0.0063 0.0063
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0005 0.0002
Echinococcus granulosus tyrosine protein kinase Fyn 0.0077 0.0815 0.1014
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0127 0.1424 0.1422
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0171 0.0376
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0005 0.0005
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0171 0.0376
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0005 0.0002
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0105 0.0102
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0005 0.0003
Onchocerca volvulus 0.001 0.0005 0.0005
Entamoeba histolytica protein kinase, putative 0.0062 0.0631 0.1417
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0005 0.0002
Schistosoma mansoni hypothetical protein 0.0016 0.0073 0.0091
Echinococcus multilocularis cyclin dependent kinase 0.0296 0.3477 0.3606
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0105 0.0227
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.01 0.1093 0.1364
Echinococcus multilocularis nibrin 0.001 0.0004 0.0002
Trichomonas vaginalis CMGC family protein kinase 0.0296 0.3477 0.7834
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0144 0.0316
Loa Loa (eye worm) AGC/PKG protein kinase 0.0011 0.0016 0.0014
Echinococcus granulosus FTZ F1 alpha 0.001 0.0005 0.0003
Schistosoma mansoni serine/threonine protein kinase 0.0011 0.0016 0.0021
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0077 0.0815 0.1014
Trichomonas vaginalis CMGC family protein kinase 0.0375 0.4438 1
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0296 0.3477 0.7834
Echinococcus granulosus tyrosine protein kinase Src64B 0.0077 0.0815 0.1014
Loa Loa (eye worm) hypothetical protein 0.0015 0.0063 0.0061
Entamoeba histolytica protein kinase, putative 0.0375 0.4438 1
Trypanosoma cruzi aminopeptidase, putative 0.0015 0.0063 0.0133
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0077 0.0815 0.0843
Brugia malayi ATP dependent DNA ligase C terminal region family protein 0.001 0.0004 0.0002
Echinococcus granulosus NCK adaptor protein 0.0015 0.0067 0.0081
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0077 0.0815 0.0843
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0015 0.0063 0.0133
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0326 0.0403
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0296 0.3477 0.4336
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0005 0.0006
Loa Loa (eye worm) hypothetical protein 0.0029 0.0238 0.0235
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0005 0.0002
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0005 0.0002
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0005 0.0003
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0105 0.0227
Trypanosoma brucei ULK family serine/threonine-protein kinase, putative 0.0013 0.0037 0.0075
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0015 0.0063 0.0079
Echinococcus granulosus cyclin dependent kinase 5 0.0296 0.3477 0.4336
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0015 0.0063 0.0063
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0005 0.0002
Trichomonas vaginalis CMGC family protein kinase 0.0296 0.3477 0.7834
Echinococcus granulosus tyrosine protein kinase Fyn 0.0077 0.0815 0.1014
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0015 0.0063 0.0133
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0073 0.0073
Brugia malayi intracellular kinase 0.0375 0.4438 0.4436
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0015 0.0063 0.0076
Schistosoma mansoni hypothetical protein 0.0016 0.0073 0.0091
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0073 0.0091
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0327 0.3858 0.8693
Onchocerca volvulus 0.0015 0.0063 0.0137
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0105 0.0227
Echinococcus multilocularis GPCR, family 2 0.0016 0.0073 0.0073
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0005 0.0003
Giardia lamblia Kinase, CMGC CDK 0.0296 0.3477 0.7834
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0279 0.3274 0.3394
Echinococcus granulosus importin subunit beta 1 0.0029 0.0238 0.0294
Schistosoma mansoni ran 0.0021 0.0144 0.018
Brugia malayi Variant SH3 domain containing protein 0.0015 0.0067 0.0065
Onchocerca volvulus 0.015 0.1701 0.383
Schistosoma mansoni growth factor receptor-bound protein 0.0015 0.0067 0.0084
Brugia malayi RNA recognition motif domain containing protein 0.0127 0.1424 0.1422
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0069 0.0724 0.0901
Schistosoma mansoni tar DNA-binding protein 0.0127 0.1424 0.1777
Loa Loa (eye worm) hypothetical protein 0.0145 0.1644 0.1642
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0005 0.0003
Echinococcus granulosus tyrosine protein kinase Src42A 0.0077 0.0815 0.1014
Entamoeba histolytica hypothetical protein 0.001 0.0004 0.0004
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0077 0.0815 0.0843
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0005 0.0002
Brugia malayi protein-tyrosine kinase 0.0069 0.0724 0.0722
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0005 0.0002
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0015 0.0063 0.0106
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0073 0.0073
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0073 0.0088
Schistosoma mansoni tar DNA-binding protein 0.0127 0.1424 0.1777
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0073 0.0156
Schistosoma mansoni chromosome transmission fidelity factor 0.001 0.0004 0.0005
Loa Loa (eye worm) TATA binding protein associated factor 0.0015 0.0063 0.0061
Mycobacterium ulcerans aminopeptidase N PepN 0.0015 0.0063 0.5868
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0005 0.0002
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0077 0.0815 0.0843
Schistosoma mansoni thyroid hormone receptor 0.001 0.0005 0.0006
Loa Loa (eye worm) hypothetical protein 0.001 0.0004 0.0002
Schistosoma mansoni ran 0.0021 0.0144 0.018
Loa Loa (eye worm) TAR-binding protein 0.0127 0.1424 0.1422
Entamoeba histolytica Ran family GTPase 0.0021 0.0144 0.032
Schistosoma mansoni tyrosine kinase 0.0077 0.0815 0.1017
Echinococcus granulosus cyclin dependent kinase 1 0.0296 0.3477 0.4336
Echinococcus granulosus c src tyrosine kinase 0.0017 0.0093 0.0113
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0296 0.3477 0.7828
Echinococcus multilocularis aminopeptidase N 0.0015 0.0063 0.0063
Trypanosoma cruzi malonyl-CoA decarboxylase, mitochondrial precursor, putative 0.0327 0.3858 0.8693
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0015 0.0063 0.0079
Loa Loa (eye worm) hypothetical protein 0.015 0.1701 0.1699
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0483 0.0481

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 590 nM Inhibition of human leukotriene A4 hydrolase ChEMBL. 21377770
IC50 (functional) = 0.55 uM Inhibitory activity was determined for LTB4 production in human whole blood. ChEMBL. 10691697
IC50 (functional) = 0.55 uM Inhibitory activity was determined for LTB4 production in human whole blood. ChEMBL. 10691697
IC50 (binding) = 0.59 uM Inhibitory activity was determined against Leukotriene A4 hydrolase ChEMBL. 10691697
IC50 (binding) = 0.59 uM Inhibitory activity was determined against Leukotriene A4 hydrolase ChEMBL. 10691697
Inhibition (functional) = 83 % Percent inhibition was determined at a dose of 10 mg/Kg in mouse ex vivo assay ChEMBL. 10691697
Inhibition (functional) = 83 % Percent inhibition was determined at a dose of 10 mg/Kg in mouse ex vivo assay 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

2 literature references were collected for this gene.

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