Detailed information for compound 37150

Basic information

Technical information
  • TDR Targets ID: 37150
  • Name: 4-(3-methoxy-5-phenylpyrazol-1-yl)benzenesulf onamide
  • MW: 329.374 | Formula: C16H15N3O3S
  • H donors: 1 H acceptors: 3 LogP: 2.42 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1nn(c(c1)c1ccccc1)c1ccc(cc1)S(=O)(=O)N
  • InChi: 1S/C16H15N3O3S/c1-22-16-11-15(12-5-3-2-4-6-12)19(18-16)13-7-9-14(10-8-13)23(17,20)21/h2-11H,1H3,(H2,17,20,21)
  • InChiKey: PBVNDCIXBNKYOR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(3-methoxy-5-phenyl-pyrazol-1-yl)benzenesulfonamide
  • 4-(3-methoxy-5-phenyl-1-pyrazolyl)benzenesulfonamide

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Trichomonas vaginalis aldo-keto reductase, putative 0.0084 0.1089 0.2408
Plasmodium falciparum cysteine repeat modular protein 1 0.0023 0.0178 0.0089
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Schistosoma mansoni coup transcription factor 0.002 0.014 0.0237
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0291 0.4143 1
Mycobacterium tuberculosis Conserved protein 0.0084 0.1089 0.2408
Echinococcus granulosus tissue type plasminogen activator 0.0023 0.0178 0.0178
Echinococcus multilocularis dna polymerase eta 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0023 0.0178 0.0429
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0023 0.0187 0.0197
Giardia lamblia Malate dehydrogenase 0.0045 0.0502 0.0951
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Schistosoma mansoni hypothetical protein 0.0055 0.0654 0.1108
Onchocerca volvulus 0.0291 0.4143 1
Echinococcus granulosus dna polymerase eta 0.0019 0.012 0.012
Trichomonas vaginalis aldo/keto reductase, putative 0.0291 0.4143 1
Leishmania major phosphopantetheinyl transferase-like protein 0.0023 0.0187 0.0166
Onchocerca volvulus 0.0083 0.1064 0.2461
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0055 0.0654 0.0654
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Schistosoma mansoni apoptosis regulator bax 0.0055 0.0654 0.1108
Schistosoma mansoni hypothetical protein 0.0154 0.2113 0.3581
Loa Loa (eye worm) TK/ROR protein kinase 0.0023 0.0178 0.0429
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0558 0.1347
Onchocerca volvulus 0.0108 0.1444 0.339
Echinococcus granulosus cytosolic malate dehydrogenase 0.0045 0.0502 0.0502
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.014 0.0338
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.014 0.0237
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Brugia malayi nuclear hormone receptor 0.002 0.014 0.0338
Schistosoma mansoni malate dehydrogenase 0.0045 0.0502 0.0851
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0187 0.0104
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0084 0.1089 0.2628
Trypanosoma cruzi malate dehydrogenase, putative 0.0019 0.012 0.0001
Leishmania major malate dehydrogenase, putative 0.0019 0.012 0.0001
Loa Loa (eye worm) hypothetical protein 0.0019 0.012 0.029
Onchocerca volvulus Matrix metalloproteinase homolog 0.0241 0.3394 0.8164
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Brugia malayi Probable malate dehydrogenase, mitochondrial precursor 0.0019 0.012 0.0291
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0069 0.0168
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Schistosoma mansoni hypothetical protein 0.0055 0.0654 0.1108
Schistosoma mansoni glutaminase 0.0266 0.3765 0.6379
Entamoeba histolytica aldose reductase, putative 0.0291 0.4143 1
Mycobacterium leprae PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE DXR (DXP REDUCTOISOMERASE) (1-DEOXYXYLULOSE-5-PHOSPHATE REDUCTOISOMERAS 0.0452 0.652 1
Trypanosoma cruzi aldo-keto reductase 0.0291 0.4143 1
Leishmania major aldo-keto reductase-like protein 0.0291 0.4143 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Echinococcus multilocularis lactate dehydrogenase a 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0055 0.0654 0.1579
Schistosoma mansoni malate dehydrogenase 0.0019 0.012 0.0204
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.014 0.014
Brugia malayi Hemopexin family protein 0.0154 0.2113 0.51
Brugia malayi Protein kinase domain containing protein 0.0023 0.0178 0.0429
Trypanosoma brucei RNA helicase, putative 0.0107 0.1428 0.3392
Giardia lamblia Aldose reductase 0.0291 0.4143 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.014 0.014
Loa Loa (eye worm) matrixin family protein 0.0262 0.3714 0.8963
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0084 0.1089 0.2408
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.012 0.029
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0023 0.0187 0.0104
Brugia malayi CXXC zinc finger family protein 0.0029 0.0269 0.0648
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0187 0.0104
Echinococcus granulosus lactate dehydrogenase a 0.0019 0.012 0.012
Entamoeba histolytica alcohol dehydrogenase, putative 0.0084 0.1089 0.2408
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.014 0.0338
Trichomonas vaginalis malate dehydrogenase, putative 0.0035 0.036 0.0597
Plasmodium falciparum aldehyde reductase, putative 0.0084 0.1089 0.1513
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0688 1 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0069 0.0168
Entamoeba histolytica malate dehydrogenase,cytoplasmic, putative 0.0045 0.0502 0.0951
Loa Loa (eye worm) hypothetical protein 0.0108 0.1444 0.3485
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Mycobacterium tuberculosis Probable malate dehydrogenase Mdh 0.0045 0.0502 0.0951
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Schistosoma mansoni hypothetical protein 0.0107 0.1428 0.242
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Echinococcus multilocularis lactate dehydrogenase protein 0.0019 0.012 0.012
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0291 0.4143 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0332 0.0801
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Plasmodium falciparum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.652 1
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.014 0.0338
Brugia malayi steroid hormone receptor 0.002 0.014 0.0338
Trichomonas vaginalis aldo-keto reductase, putative 0.0084 0.1089 0.2408
Echinococcus granulosus aldo keto reductase 0.0291 0.4143 0.4143
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.014 0.0338
Loa Loa (eye worm) matrix metalloproteinase 0.0108 0.1444 0.3485
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.012 0.029
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Schistosoma mansoni hypothetical protein 0.0023 0.0178 0.0301
Loa Loa (eye worm) malate dehydrogenase 0.0045 0.0502 0.1213
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.014 0.0237
Echinococcus multilocularis FTZ F1 alpha 0.002 0.014 0.014
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0502 0.0951
Loa Loa (eye worm) matrixin family protein 0.0241 0.3394 0.8191
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.014 0.014
Echinococcus granulosus dna polymerase kappa 0.0019 0.012 0.012
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.014 0.0338
Onchocerca volvulus 0.0029 0.0269 0.0512
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Leishmania major glycosomal malate dehydrogenase 0.0019 0.012 0.0001
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.014 0.014
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.014 0.0338
Onchocerca volvulus 0.0291 0.4143 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.012 0.0203
Toxoplasma gondii aldose reductase, putative 0.0291 0.4143 0.6322
Chlamydia trachomatis 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.652 1
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0045 0.0502 0.0502
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.014 0.0338
Trichomonas vaginalis malate dehydrogenase, putative 0.0019 0.012 0.0001
Leishmania major prostaglandin f synthase, putative 0.0291 0.4143 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0069 0.0168
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0291 0.4143 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.014 0.014
Echinococcus granulosus GPCR family 2 0.0015 0.0069 0.0069
Schistosoma mansoni cpg binding protein 0.003 0.0293 0.0496
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Schistosoma mansoni thyroid hormone receptor 0.002 0.014 0.0237
Echinococcus multilocularis malate dehydrogenase 0.0019 0.012 0.012
Schistosoma mansoni hypothetical protein 0.0033 0.0332 0.0563
Chlamydia trachomatis malate dehydrogenase 0.0045 0.0502 0.0499
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0291 0.4143 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.012 0.0291
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.012 0.0203
Echinococcus granulosus malate dehydrogenase 0.0019 0.012 0.012
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0019 0.012 0.0001
Echinococcus multilocularis dna polymerase kappa 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Onchocerca volvulus 0.0291 0.4143 1
Brugia malayi Matrixin family protein 0.0108 0.1444 0.3485
Onchocerca volvulus 0.0154 0.2113 0.5028
Trypanosoma cruzi aldo/keto reductase, putative 0.0291 0.4143 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0291 0.4143 1
Echinococcus multilocularis voltage gated potassium channel subunit 0.0084 0.1089 0.1089
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Trypanosoma brucei malate dehydrogenase-related 0.0019 0.012 0.021
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0291 0.4143 1
Echinococcus multilocularis GPCR, family 2 0.0015 0.0069 0.0069
Echinococcus multilocularis dnaJ subfamily B 0.0411 0.5901 0.5901
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0045 0.0502 0.1213
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) PAN domain-containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0269 0.0648
Trypanosoma brucei prostaglandin f synthase 0.0291 0.4143 1
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.014 0.0237
Mycobacterium ulcerans 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.652 1
Trypanosoma brucei mitochondrial malate dehydrogenase 0.0019 0.012 0.021
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0394 0.5664 0.5664
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0023 0.0187 0.0104
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.014 0.0338
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0055 0.0654 0.0654
Loa Loa (eye worm) hypothetical protein 0.0048 0.0558 0.1347
Loa Loa (eye worm) hypothetical protein 0.0033 0.0332 0.0801
Echinococcus multilocularis lactate dehydrogenase a 0.0019 0.012 0.012
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.014 0.0338
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0069 0.0069
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.014 0.014
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.014 0.014
Treponema pallidum 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.652 1
Trypanosoma brucei unspecified product 0.0019 0.012 0.0209
Echinococcus multilocularis aldo keto reductase 0.0291 0.4143 0.4143
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0045 0.0502 0.0951
Schistosoma mansoni hypothetical protein 0.0015 0.0069 0.0118
Mycobacterium leprae PROBABLE MALATE DEHYDROGENASE MDH 0.0045 0.0502 0.0499
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Brugia malayi Matrixin family protein 0.0262 0.3714 0.8963
Onchocerca volvulus Matrilysin homolog 0.0108 0.1444 0.339
Echinococcus granulosus voltage gated potassium channel subunit 0.0084 0.1089 0.1089
Echinococcus granulosus lactate dehydrogenase a 0.0019 0.012 0.012
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.0209
Onchocerca volvulus 0.0291 0.4143 1
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0083 0.1064 0.1804
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.014 0.0338
Schistosoma mansoni nuclear hormone receptor 0.002 0.014 0.0237
Echinococcus granulosus cytosolic malate dehydrogenase 0.0045 0.0502 0.0502
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.014 0.0338
Leishmania major malate dehydrogenase, putative 0.0019 0.012 0.0001
Echinococcus multilocularis aldehyde reductase 0.0207 0.2898 0.2898
Entamoeba histolytica aldose reductase, putative 0.0291 0.4143 1
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0132 0.1793 0.4158
Brugia malayi glutaminase DH11.1 0.0266 0.3765 0.9086
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0291 0.4143 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.014 0.0338
Mycobacterium ulcerans hypothetical protein 0.0084 0.1089 0.1514
Echinococcus granulosus aldo keto reductase 0.0291 0.4143 0.4143
Brugia malayi Steroid receptor seven-up type 2 0.002 0.014 0.0338
Onchocerca volvulus Protein ultraspiracle homolog 0.002 0.014 0.0198
Brugia malayi Kringle domain containing protein 0.0023 0.0178 0.0429
Entamoeba histolytica aldose reductase, putative 0.0291 0.4143 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.014 0.0338
Giardia lamblia Aldose reductase 0.0291 0.4143 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.014 0.0237
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0084 0.1089 0.1593
Trichomonas vaginalis conserved hypothetical protein 0.0084 0.1089 0.2408
Loa Loa (eye worm) oxidoreductase 0.0291 0.4143 1
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0045 0.0502 0.0502
Entamoeba histolytica hypothetical protein 0.0023 0.0187 0.0166
Toxoplasma gondii aldo-keto reductase 0.0084 0.1089 0.1593
Echinococcus granulosus aldo keto reductase 0.0291 0.4143 0.4143
Loa Loa (eye worm) steroid hormone receptor 0.002 0.014 0.0338
Trypanosoma brucei cytosolic malate dehydrogenase 0.0045 0.0502 0.114
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0502 0.0951
Echinococcus multilocularis L lactate dehydrogenase B chain 0.0019 0.012 0.012
Brugia malayi lactate dehydrogenase. 0.0019 0.012 0.0291
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Entamoeba histolytica alcohol dehydrogenase, putative 0.0084 0.1089 0.2408
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.014 0.014
Schistosoma mansoni cpg binding protein 0.003 0.0293 0.0496
Trypanosoma brucei aldo-keto reductase, putative 0.0291 0.4143 1
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0084 0.1089 0.2628
Loa Loa (eye worm) hypothetical protein 0.0015 0.0069 0.0168
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0045 0.0502 0.0951
Mycobacterium leprae Possible oxidoreductase 0.0084 0.1089 0.1424
Loa Loa (eye worm) malate dehydrogenase 0.0019 0.012 0.0291
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0084 0.1089 0.1089
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.014 0.0338
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.014 0.014
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0019 0.012 0.0001
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Brugia malayi NADH-dependent xylose reductase 0.0084 0.1089 0.2628
Onchocerca volvulus 0.002 0.014 0.0198
Echinococcus multilocularis aldo keto reductase 0.0291 0.4143 0.4143
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Schistosoma mansoni aldo-keto reductase 0.0291 0.4143 0.7021
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0069 0.0069
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.012 0.012
Mycobacterium leprae PROBABLE HYDROLASE 0.0132 0.1793 0.2536
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Schistosoma mansoni potassium channel beta 0.0084 0.1089 0.1845
Schistosoma mansoni hypothetical protein 0.0015 0.0069 0.0118
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Schistosoma mansoni hypothetical protein 0.0411 0.5901 1
Trypanosoma brucei glycosomal malate dehydrogenase 0.0019 0.012 0.021
Schistosoma mansoni L-lactate dehydrogenase 0.0019 0.012 0.0204
Trichomonas vaginalis aldo-keto reductase, putative 0.0084 0.1089 0.2408
Brugia malayi Matrixin family protein 0.0108 0.1444 0.3485
Echinococcus multilocularis cpg binding protein 0.003 0.0293 0.0293
Toxoplasma gondii 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0452 0.652 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Echinococcus granulosus L lactate dehydrogenase B chain 0.0019 0.012 0.012
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.014 0.0237
Echinococcus granulosus cpg binding protein 0.003 0.0293 0.0293
Wolbachia endosymbiont of Brugia malayi 1-deoxy-D-xylulose 5-phosphate reductoisomerase 0.0452 0.652 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0069 0.0069
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.012 0.0209
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.014 0.014
Toxoplasma gondii malate dehydrogenase MDH 0.0019 0.012 0.0094
Plasmodium vivax aldehyde reductase, putative 0.0084 0.1089 0.1513
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0558 0.1347
Toxoplasma gondii lactate dehydrogenase LDH1 0.0019 0.012 0.0094
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.014 0.0338
Brugia malayi nuclear receptor NHR-88 0.002 0.014 0.0338
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.012 0.029
Echinococcus granulosus hypothetical protein 0.0291 0.4143 0.4143
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.014 0.0338
Mycobacterium tuberculosis Probable oxidoreductase 0.0291 0.4143 1
Schistosoma mansoni malate dehydrogenase 0.0019 0.012 0.0204
Echinococcus granulosus lactate dehydrogenase protein 0.0019 0.012 0.012
Toxoplasma gondii kringle domain-containing protein 0.0023 0.0178 0.0183
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.014 0.014
Mycobacterium ulcerans glutaminase 0.0266 0.3765 0.5695
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0291 0.4143 1
Echinococcus granulosus FTZ F1 alpha 0.002 0.014 0.014
Echinococcus granulosus aldehyde reductase 0.0207 0.2898 0.2898
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Mycobacterium leprae Conserved hypothetical protein 0.0207 0.2898 0.4281
Leishmania major cytosolic malate dehydrogenase 0.0045 0.0502 0.0951
Echinococcus multilocularis aldo keto reductase 0.0291 0.4143 0.4143
Trypanosoma cruzi aldo/keto reductase, putative 0.0084 0.1089 0.2408
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0055 0.0654 0.1108
Loa Loa (eye worm) oxidoreductase 0.0291 0.4143 1
Mycobacterium ulcerans malate dehydrogenase 0.0045 0.0502 0.0598
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0069 0.0069
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0023 0.0187 0.0104
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.014 0.0338
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0394 0.5664 0.5664
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0084 0.1089 0.1593
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0291 0.4143 0.6248
Loa Loa (eye worm) PAN domain-containing protein 0.0015 0.0059 0.0143
Entamoeba histolytica malate dehydrogenase, putative 0.0019 0.012 0.0001
Echinococcus granulosus L aminoadipate semialdehyde 0.0083 0.1064 0.1064
Echinococcus multilocularis L aminoadipate semialdehyde 0.0083 0.1064 0.1064
Onchocerca volvulus 0.0023 0.0178 0.0289
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0502 0.0951
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.002 0.014 0.0198
Onchocerca volvulus Bile acid receptor homolog 0.002 0.014 0.0198
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) hypothetical protein 0.0132 0.1793 0.4327
Schistosoma mansoni hypothetical protein 0.0055 0.0654 0.1108
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.0209
Schistosoma mansoni L-lactate dehydrogenase 0.0019 0.012 0.0204
Loa Loa (eye worm) oxidoreductase 0.0291 0.4143 1
Plasmodium vivax 1-deoxy-D-xylulose 5-phosphate reductoisomerase, putative 0.0452 0.652 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.014 0.0338
Loa Loa (eye worm) glutaminase 0.0266 0.3765 0.9086
Schistosoma mansoni malate dehydrogenase 0.0045 0.0502 0.0851
Echinococcus multilocularis malate dehydrogenase 0.0019 0.012 0.012
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Onchocerca volvulus 0.0084 0.1089 0.252
Loa Loa (eye worm) hypothetical protein 0.0108 0.1444 0.3485
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Leishmania major mitochondrial malate dehydrogenase 0.0019 0.012 0.0001
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0084 0.1089 0.1513
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0055 0.0654 0.1579
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0745 0.1263
Schistosoma mansoni hypothetical protein 0.0015 0.0069 0.0118
Trichomonas vaginalis aldo/keto reductase, putative 0.0291 0.4143 1
Trypanosoma cruzi malate dehydrogenase, putative 0.0019 0.012 0.0001
Leishmania major malate dehydrogenase 0.0019 0.012 0.0001
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0083 0.1064 0.2569
Schistosoma mansoni DNA polymerase eta 0.0019 0.012 0.0203
Echinococcus multilocularis lactate dehydrogenase a 0.0019 0.012 0.012
Schistosoma mansoni thyroid hormone receptor 0.002 0.014 0.0237
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Trypanosoma brucei aldo/keto reductase, putative 0.0084 0.1089 0.2567
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Loa Loa (eye worm) PAN domain-containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) glutaminase 2 0.0266 0.3765 0.9086
Onchocerca volvulus 0.0291 0.4143 1
Echinococcus granulosus malate dehydrogenase 0.0019 0.012 0.012
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0045 0.0502 0.0951
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.012 0.0209
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.014 0.0338
Loa Loa (eye worm) PAN domain-containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) hypothetical protein 0.0108 0.1444 0.3485
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.014 0.0338
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.014 0.0237
Leishmania major hypothetical protein, conserved 0.0023 0.0178 0.0143
Mycobacterium ulcerans oxidoreductase 0.0291 0.4143 0.6287
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.014 0.0237
Loa Loa (eye worm) oxidoreductase 0.0291 0.4143 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0291 0.4143 0.4143
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0649 0.0913
Trypanosoma brucei hypothetical protein, conserved 0.0023 0.0187 0.0371
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0084 0.1089 0.2408
Onchocerca volvulus 0.0291 0.4143 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.014 0.0237
Echinococcus multilocularis aldo keto reductase 0.0291 0.4143 0.4143
Mycobacterium tuberculosis Probable 1-deoxy-D-xylulose 5-phosphate reductoisomerase Dxr (DXP reductoisomerase) (1-deoxyxylulose-5-phosphate reductoisomeras 0.0109 0.1449 0.3303
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0023 0.0187 0.0166
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.014 0.0237
Trichomonas vaginalis aldo/keto reductase, putative 0.0291 0.4143 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0291 0.4143 1
Toxoplasma gondii lactate dehydrogenase LDH2 0.0019 0.012 0.0094
Echinococcus granulosus dnaJ subfamily B 0.0411 0.5901 0.5901
Schistosoma mansoni pol-related 0.0291 0.4143 0.7021
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0291 0.4143 0.4143
Brugia malayi Matrixin family protein 0.0108 0.1444 0.3485
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.014 0.0338
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Loa Loa (eye worm) oxidoreductase 0.0291 0.4143 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Brugia malayi Matrixin family protein 0.0108 0.1444 0.3485
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.014 0.014
Mycobacterium ulcerans hydrolase 0.0132 0.1793 0.2614
Schistosoma mansoni cpg binding protein 0.0029 0.0269 0.0455
Schistosoma mansoni aldo-keto reductase 0.0291 0.4143 0.7021
Trichomonas vaginalis aldo-keto reductase, putative 0.0291 0.4143 1
Trichomonas vaginalis glutaminase, putative 0.0266 0.3765 0.9059
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0108 0.1444 0.2447
Schistosoma mansoni hypothetical protein 0.0015 0.0069 0.0118
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.014 0.0338
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0132 0.1793 0.4327
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.014 0.014
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.014 0.014
Entamoeba histolytica malate dehydrogenase, putative 0.0045 0.0502 0.0951
Onchocerca volvulus Matrilysin homolog 0.0241 0.3394 0.8164
Echinococcus multilocularis tissue type plasminogen activator 0.0023 0.0178 0.0178
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Brugia malayi ecdysteroid receptor 0.002 0.014 0.0338
Loa Loa (eye worm) PAN domain-containing protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) hypothetical protein 0.0083 0.1064 0.2569
Loa Loa (eye worm) hypothetical protein 0.002 0.014 0.0338
Brugia malayi PAN domain containing protein 0.0015 0.0059 0.0143
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0023 0.0187 0.0197
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.012 0.0209
Loa Loa (eye worm) hypothetical protein 0.0015 0.0059 0.0143
Loa Loa (eye worm) hypothetical protein 0.0291 0.4143 1
Loa Loa (eye worm) apoptosis regulator protein 0.0055 0.0654 0.1579
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.014 0.014
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0558 0.1347
Trichomonas vaginalis malate dehydrogenase, putative 0.0045 0.0502 0.0951
Plasmodium falciparum aldo-keto reductase, putative 0.0084 0.1089 0.1513
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0023 0.0178 0.0089
Trypanosoma cruzi mitochondrial malate dehydrogenase, putative 0.0019 0.012 0.0001
Trypanosoma cruzi hypothetical protein, conserved 0.0023 0.0178 0.0143
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.014 0.014

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 100 uM In vitro inhibitory concentration required to block recombinant human prostaglandin G/H synthase 1 (COX-1) ChEMBL. 9135032
IC50 (binding) > 100 uM In vitro inhibitory concentration required to block human recombinant prostaglandin G/H synthase 2 (COX-2) ChEMBL. 9135032
IC50 (binding) > 100 uM In vitro inhibitory concentration required to block recombinant human prostaglandin G/H synthase 1 (COX-1) ChEMBL. 9135032
IC50 (binding) > 100 uM In vitro inhibitory concentration required to block human recombinant prostaglandin G/H synthase 2 (COX-2) ChEMBL. 9135032

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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