Detailed information for compound 88376

Basic information

Technical information
  • TDR Targets ID: 88376
  • Name: 1-[[5-(4-chlorophenyl)sulfanylthiophen-2-yl]m ethyl]-1-hydroxyurea
  • MW: 314.811 | Formula: C12H11ClN2O2S2
  • H donors: 2 H acceptors: 2 LogP: 2.9 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)Sc1ccc(s1)CN(C(=O)N)O
  • InChi: 1S/C12H11ClN2O2S2/c13-8-1-3-9(4-2-8)18-11-6-5-10(19-11)7-15(17)12(14)16/h1-6,17H,7H2,(H2,14,16)
  • InChiKey: IQAYUHJVEJQQKN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[[5-(4-chlorophenyl)sulfanyl-2-thienyl]methyl]-1-hydroxy-urea
  • 1-[[5-[(4-chlorophenyl)thio]-2-thienyl]methyl]-1-hydroxyurea
  • 1-[[5-(4-chlorophenyl)sulfanylthiophen-2-yl]methyl]-1-hydroxy-urea
  • 1-[[5-[(4-chlorophenyl)thio]-2-thienyl]methyl]-1-hydroxy-urea

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Rattus norvegicus Arachidonate 5-lipoxygenase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma japonicum ko:K00461 arachidonate 5-lipoxygenase [EC1.13.11.34], putative Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma japonicum IPR001024,Lipoxygenase, LH2;IPR013819,Lipoxygenase, C-terminal,domain-containing Get druggable targets OG5_127482 All targets in OG5_127482
Echinococcus granulosus arachidonate 5 lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Echinococcus multilocularis arachidonate 5 lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
Schistosoma mansoni lipoxygenase Get druggable targets OG5_127482 All targets in OG5_127482
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium vivax glutathione reductase, putative 0.0037 0.0174 0.8568
Onchocerca volvulus 0.0231 0.1714 0.1714
Onchocerca volvulus 0.004 0.0199 0.0199
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0103 0.023
Plasmodium vivax thioredoxin reductase, putative 0.0037 0.0174 0.8568
Brugia malayi MH2 domain containing protein 0.0017 0.0017 0.0017
Echinococcus granulosus excitatory amino acid transporter 3 0.1277 1 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.007 0.0054
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0284 0.0268
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0045 0.0115
Loa Loa (eye worm) carbonic anhydrase 3 0.0582 0.4498 0.4498
Brugia malayi hypothetical protein 0.0024 0.007 0.007
Echinococcus granulosus Excitatory amino acid transporter 0.1277 1 1
Schistosoma mansoni hypothetical protein 0.0165 0.1193 0.1178
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0216 0.1596 0.1596
Schistosoma mansoni aldehyde dehydrogenase 0.0131 0.0916 0.0901
Brugia malayi Thioredoxin reductase 0.0037 0.0174 0.0174
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0027 0.001
Loa Loa (eye worm) thioredoxin reductase 0.0037 0.0174 0.0174
Onchocerca volvulus Excitatory amino acid transporter homolog 0.1277 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0131 0.0916 1
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0199 0.0172
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0131 0.0916 0.0891
Trichomonas vaginalis ran, putative 0.0021 0.0045 0.0262
Schistosoma mansoni hypothetical protein 0.0165 0.1193 0.1178
Mycobacterium tuberculosis Probable dehydrogenase 0.0084 0.0549 0.0524
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0199 0.0172
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0094 0.0624 1
Echinococcus multilocularis excitatory amino acid transporter 3 0.1277 1 1
Schistosoma mansoni alpha glucosidase 0.004 0.02 0.0184
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0199 0.1159
Loa Loa (eye worm) glutathione reductase 0.0037 0.0174 0.0174
Echinococcus multilocularis thioredoxin glutathione reductase 0.0037 0.0178 0.0162
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0045 0.0045
Plasmodium vivax hypothetical protein, conserved 0.004 0.0199 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0027 0.006
Echinococcus granulosus geminin 0.0165 0.1193 0.1178
Loa Loa (eye worm) hypothetical protein 0.0029 0.0112 0.0112
Mycobacterium ulcerans aldehyde dehydrogenase 0.0131 0.0916 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0084 0.0549 0.0524
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0084 0.0549 0.8246
Brugia malayi RNA, U transporter 1 0.008 0.0513 0.0513
Mycobacterium tuberculosis Conserved protein 0.004 0.0199 0.0172
Echinococcus granulosus RUN 0.0024 0.007 0.0054
Echinococcus multilocularis neutral amino acid transporter A 0.1277 1 1
Echinococcus multilocularis sodium:dicarboxylate symporter 0.0566 0.4366 0.4357
Loa Loa (eye worm) hypothetical protein 0.0216 0.1596 0.1596
Echinococcus multilocularis Excitatory amino acid transporter 0.1277 1 1
Echinococcus multilocularis carbonic anhydrase 0.0216 0.1596 0.1582
Echinococcus granulosus lysosomal alpha glucosidase 0.0181 0.1317 0.1303
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0061 0.0137
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0199 0.0182
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0103 0.023
Echinococcus granulosus neutral amino acid transporter A 0.1277 1 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0037 0.0174 0.0148
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0061 0.0359
Echinococcus multilocularis excitatory amino acid transporter 2 0.1277 1 1
Echinococcus multilocularis snurportin 1 0.0299 0.2253 0.224
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Brugia malayi beta-lactamase 0.004 0.0199 0.0199
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0199 0.0182
Brugia malayi MH2 domain containing protein 0.025 0.1866 0.1866
Echinococcus granulosus carbonic anhydrase II 0.0582 0.4498 0.4489
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0112 0.0096
Plasmodium vivax SET domain protein, putative 0.0029 0.0112 0.4975
Loa Loa (eye worm) hypothetical protein 0.0216 0.1596 0.1596
Brugia malayi MH2 domain containing protein 0.0017 0.0017 0.0017
Onchocerca volvulus 0.0029 0.0112 0.0112
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0199 0.1159
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0199 0.0182
Echinococcus granulosus Excitatory amino acid transporter 0.1277 1 1
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0216 0.1596 0.1596
Entamoeba histolytica hypothetical protein 0.0023 0.0061 0.3074
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0112 0.0096
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.0112 0.0096
Brugia malayi hypothetical protein 0.0016 0.0007 0.0007
Plasmodium falciparum importin beta, putative 0.0028 0.0103 0.0489
Echinococcus multilocularis Excitatory amino acid transporter 0.1277 1 1
Loa Loa (eye worm) doublecortin family protein 0.0024 0.007 0.007
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.0112 0.0096
Toxoplasma gondii ABC1 family protein 0.004 0.0199 0.1095
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.0264 0.0248
Brugia malayi beta-lactamase family protein 0.004 0.0199 0.0199
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0094 0.0624 0.0598
Echinococcus multilocularis muscleblind protein 1 0.0311 0.2349 0.2336
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.02 0.0184
Plasmodium falciparum carbonic anhydrase 0.0216 0.1596 1
Trichomonas vaginalis set domain proteins, putative 0.0231 0.1714 1
Echinococcus multilocularis tumor protein p63 0.033 0.2496 0.2484
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0199 0.0199
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0199 0.0172
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.007 0.0054
Brugia malayi hypothetical protein 0.0024 0.007 0.007
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0582 0.4498 0.4498
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0094 0.0624 0.0598
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0582 0.4498 0.4498
Echinococcus granulosus tumor protein p63 0.033 0.2496 0.2484
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.02 0.02
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0045 0.01
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0203 0.1492 0.1492
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0076 0.017
Loa Loa (eye worm) beta-lactamase 0.004 0.0199 0.0199
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0199 0.0442
Echinococcus granulosus carbonic anhydrase 0.0216 0.1596 0.1582
Brugia malayi Pre-SET motif family protein 0.0029 0.0112 0.0112
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0045 0.0115
Schistosoma mansoni alpha-glucosidase 0.0156 0.1117 0.1103
Echinococcus granulosus sodium:dicarboxylate symporter 0.1277 1 1
Onchocerca volvulus 0.0024 0.007 0.007
Loa Loa (eye worm) MH2 domain-containing protein 0.025 0.1866 0.1866
Loa Loa (eye worm) hypothetical protein 0.0311 0.2349 0.2349
Chlamydia trachomatis glutamate symporter 0.1277 1 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0199 0.0172
Toxoplasma gondii aldehyde dehydrogenase 0.0131 0.0916 0.5666
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0199 0.1159
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0103 0.0489
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0027 0.0027
Leishmania major carbonic anhydrase-like protein 0.0582 0.4498 1
Echinococcus multilocularis neutral amino acid transporter A 0.1277 1 1
Treponema pallidum glutamate transporter 0.0566 0.4366 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0045 0.01
Schistosoma mansoni ap endonuclease 0.0018 0.0027 0.001
Loa Loa (eye worm) hypothetical protein 0.0028 0.0103 0.0103
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.02 0.02
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0216 0.1596 0.1596
Echinococcus multilocularis neutral amino acid transporter A 0.1277 1 1
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0582 0.4498 1
Echinococcus granulosus snurportin 1 0.0299 0.2253 0.224
Brugia malayi MH1 domain containing protein 0.0017 0.0017 0.0017
Echinococcus granulosus carbonic anhydrase 0.0216 0.1596 0.1582
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0104 0.0087
Loa Loa (eye worm) excitatory amino acid transporter 0.1277 1 1
Leishmania major importin beta-1 subunit, putative 0.0023 0.0061 0.0137
Plasmodium falciparum thioredoxin reductase 0.0037 0.0174 0.0938
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0076 0.2883
Echinococcus multilocularis excitatory amino acid transporter 2 0.1277 1 1
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0582 0.4498 0.4498
Toxoplasma gondii thioredoxin reductase 0.0037 0.0174 0.0938
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.02 1
Brugia malayi MH1 domain containing protein 0.0017 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0024 0.007 0.007
Mycobacterium ulcerans aldehyde dehydrogenase 0.0131 0.0916 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0045 0.0028
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0199 0.0172
Onchocerca volvulus 0.004 0.0199 0.0199
Echinococcus granulosus neutral amino acid transporter A 0.1277 1 1
Brugia malayi Pre-SET motif family protein 0.0203 0.1492 0.1492
Echinococcus multilocularis lysosomal alpha glucosidase 0.0181 0.1317 0.1303
Schistosoma mansoni carbonic anhydrase 0.0216 0.1596 0.1582
Echinococcus multilocularis carbonic anhydrase 0.0216 0.1596 0.1582
Echinococcus multilocularis sodium:dicarboxylate symporter 0.1277 1 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.007 0.007
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0216 0.1596 0.1596
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Brugia malayi Smad1 0.0017 0.0017 0.0017
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0181 0.1317 0.1317
Onchocerca volvulus 0.0105 0.0712 0.0712
Wolbachia endosymbiont of Brugia malayi Na+/H+-dicarboxylate symporter 0.1277 1 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0199 0.0182
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0017 0.0017
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0284 0.0268
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0131 0.0916 0.0901
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.02 0.1166
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0076 0.0316
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.0112 0.0096
Echinococcus granulosus importin subunit beta 1 0.0028 0.0103 0.0087
Echinococcus multilocularis carbonic anhydrase 0.0216 0.1596 0.1582
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0566 0.4366 0.4357
Echinococcus granulosus excitatory amino acid transporter 2 0.1277 1 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0017 0.0017
Schistosoma mansoni rab6-interacting 0.0024 0.007 0.0054
Loa Loa (eye worm) hypothetical protein 0.0025 0.0076 0.0076
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0582 0.4498 1
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0061 0.0359
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0284 0.0268
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.007 0.0054
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0027 0.1343
Schistosoma mansoni hypothetical protein 0.0299 0.2253 0.224
Brugia malayi Muscleblind-like protein 0.0311 0.2349 0.2349
Onchocerca volvulus 0.004 0.0199 0.0199
Schistosoma mansoni alpha-glucosidase 0.0156 0.1117 0.1103
Echinococcus multilocularis lysosomal alpha glucosidase 0.0181 0.1317 0.1303
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0284 0.0268
Brugia malayi Glycosyl hydrolases family 31 protein 0.0181 0.1317 0.1317
Leishmania major GTP-binding protein, putative 0.0021 0.0045 0.01
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0216 0.1596 0.1596
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.02 0.1166
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.02 0.1103
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0076 0.0316
Entamoeba histolytica Ran family GTPase 0.0021 0.0045 0.2242
Plasmodium falciparum LCCL domain-containing protein 0.0024 0.007 0.0275
Leishmania major hypothetical protein, conserved 0.0025 0.0076 0.017
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0027 0.0027
Brugia malayi Importin beta-1 subunit 0.0028 0.0103 0.0103
Echinococcus multilocularis geminin 0.0165 0.1193 0.1178
Loa Loa (eye worm) hypothetical protein 0.0048 0.0264 0.0264
Mycobacterium tuberculosis Conserved protein 0.004 0.0199 0.0172
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0582 0.4498 0.4489
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0199 0.1933
Schistosoma mansoni carbonic anhydrase-related 0.0216 0.1596 0.1582
Plasmodium vivax importin-beta 2, putative 0.0028 0.0103 0.4461
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0256 0.1909 0.1887
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0045 0.0045
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0199 0.1159
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0142 0.101 0.0995
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0199 0.0442
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.02 0.1166
Echinococcus multilocularis muscleblind protein 0.0311 0.2349 0.2336
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0084 0.0549 0.0524
Trichomonas vaginalis esterase, putative 0.004 0.0199 0.1159
Mycobacterium ulcerans beta-lactamase 0.004 0.0199 0.1933
Brugia malayi Doublecortin family protein 0.0024 0.007 0.007
Treponema pallidum glutamate/aspartate transporter 0.0566 0.4366 1
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0103 0.0087
Plasmodium vivax multidomain scavenger receptor, putative 0.0024 0.007 0.2513
Leishmania major alpha glucosidase II subunit, putative 0.004 0.02 0.0445
Schistosoma mansoni carbonic anhydrase-related 0.0216 0.1596 0.1582
Trypanosoma brucei glucosidase, putative 0.004 0.02 0.0445
Plasmodium falciparum glutathione reductase 0.0037 0.0174 0.0938
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0131 0.0916 0.0901
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0199 0.0442
Onchocerca volvulus 0.0024 0.007 0.007
Echinococcus granulosus Polycystic kidney disease protein 0.0024 0.007 0.0054
Loa Loa (eye worm) Smad1 0.0017 0.0017 0.0017
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0284 0.0284
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.02 1
Schistosoma mansoni ran 0.0021 0.0045 0.0028
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0582 0.4498 0.4489
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0199 0.0199
Mycobacterium tuberculosis Probable C4-dicarboxylate-transport transmembrane protein DctA 0.1277 1 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0084 0.0549 0.0524
Schistosoma mansoni carbonic anhydrase-related 0.0216 0.1596 0.1582
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0284 0.0284
Mycobacterium tuberculosis Probable oxidoreductase 0.0094 0.0624 0.0598
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0299 0.2253 0.2253
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0076 0.017
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0199 0.1933
Loa Loa (eye worm) transcription factor SMAD2 0.025 0.1866 0.1866
Trypanosoma brucei trypanothione reductase 0.0037 0.0174 0.0387
Brugia malayi glutathione reductase 0.0037 0.0174 0.0174
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0027 0.006
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0284 0.0268
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0484 0.3715 0.3715
Mycobacterium ulcerans hypothetical protein 0.004 0.0199 0.1933
Schistosoma mansoni ran 0.0021 0.0045 0.0028
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0284 0.0268
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0045 0.0028
Echinococcus granulosus muscleblind protein 0.0311 0.2349 0.2336
Trypanosoma cruzi trypanothione reductase, putative 0.0037 0.0174 0.0387
Brugia malayi hypothetical protein 0.0025 0.0076 0.0076
Mycobacterium ulcerans lipase LipD 0.004 0.0199 0.1933
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0142 0.101 0.0995
Schistosoma mansoni polycystin 1-related 0.0024 0.007 0.0054
Schistosoma mansoni hypothetical protein 0.0216 0.1596 0.1582
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.1277 1 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0027 0.006
Toxoplasma gondii hypothetical protein 0.0216 0.1596 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0076 0.0316
Echinococcus multilocularis carbonic anhydrase II 0.0582 0.4498 0.4489
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0045 0.1047
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.02 0.0445
Schistosoma mansoni rab6-interacting 0.0024 0.007 0.0054
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0027 0.006
Echinococcus granulosus carbonic anhydrase 0.0216 0.1596 0.1582
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0027 0.001
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Mycobacterium tuberculosis Probable reductase 0.0084 0.0549 0.0524
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0284 0.0268
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0084 0.0549 0.0524
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.02 0.1166
Leishmania major hypothetical protein, conserved 0.004 0.0199 0.0442
Echinococcus granulosus excitatory amino acid transporter 2 0.1277 1 1
Schistosoma mansoni loxhd1 0.0024 0.007 0.0054
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0061 0.0359
Schistosoma mansoni lipoxygenase 0.01 0.067 0.0655
Schistosoma mansoni ap endonuclease 0.0018 0.0027 0.001
Schistosoma mansoni importin beta-1 0.0028 0.0103 0.0087
Leishmania major trypanothione reductase 0.0037 0.0174 0.0387
Loa Loa (eye worm) hypothetical protein 0.004 0.0199 0.0199
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0045 0.01
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0076 0.017
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.007 0.0054
Brugia malayi follicle stimulating hormone receptor 0.0484 0.3715 0.3715
Schistosoma mansoni lipoxygenase 0.0142 0.101 0.0995
Echinococcus multilocularis Polycystic kidney disease protein 0.0024 0.007 0.0054
Trypanosoma brucei carbonic anhydrase-like protein 0.0582 0.4498 1
Echinococcus multilocularis RUN 0.0024 0.007 0.0054
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.02 0.1166
Echinococcus granulosus thioredoxin glutathione reductase 0.0037 0.0178 0.0162
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.02 0.1166
Brugia malayi beta-lactamase family protein 0.004 0.0199 0.0199
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0045 1
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0027 0.0157
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.02 0.1166
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.02 0.0184
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0199 0.1159
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.02 0.1166
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0027 0.0157
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.02 0.0445
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0199 0.0172
Schistosoma mansoni aldehyde dehydrogenase 0.0131 0.0916 0.0901
Loa Loa (eye worm) hypothetical protein 0.0216 0.1596 0.1596
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.0112 0.0545
Onchocerca volvulus 0.0048 0.0264 0.0264
Mycobacterium tuberculosis Conserved protein 0.004 0.0199 0.0172
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0566 0.4366 0.4357
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.0566 0.4366 0.4357
Schistosoma mansoni hypothetical protein 0.0024 0.007 0.0054
Schistosoma mansoni solute carrier family 1 (glial high affinity glutamate transporter 0.1277 1 1
Echinococcus granulosus neutral amino acid transporter 0.1277 1 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.02 0.1166
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.0112 0.0096
Loa Loa (eye worm) hypothetical protein 0.0311 0.2349 0.2349
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0131 0.0916 0.2036
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0199 0.0172
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0216 0.1596 0.1596
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.0112 0.0096

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 0.26 uM Inhibition of 5-lipoxygenase on rat basophil leukemia cell line lysate (RBL-1 2H3 subline) by measuring 5-HETE production ChEMBL. 9207936
IC50 (functional) = 0.26 uM Inhibition of 5-lipoxygenase on rat basophil leukemia cell line lysate (RBL-1 2H3 subline) by measuring 5-HETE production ChEMBL. 9207936
Inhibition (functional) = 79 % Percent inhibition of LTE4 formation in rats from peritoneal fluids at a dose of 30 micro mol/Kg ChEMBL. 9207936

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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