Detailed information for compound 255591

Basic information

Technical information
  • TDR Targets ID: 255591
  • Name: 2,3-dimethyl-5-(4-methylsulfonylphenyl)-6-phe nylimidazo[2,1-b][1,3]thiazole
  • MW: 382.499 | Formula: C20H18N2O2S2
  • H donors: 0 H acceptors: 3 LogP: 5.22 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1sc2n(c1C)c(c(n2)c1ccccc1)c1ccc(cc1)S(=O)(=O)C
  • InChi: 1S/C20H18N2O2S2/c1-13-14(2)25-20-21-18(15-7-5-4-6-8-15)19(22(13)20)16-9-11-17(12-10-16)26(3,23)24/h4-12H,1-3H3
  • InChiKey: RMMFNLCTUOLYOS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,3-dimethyl-5-(4-methylsulfonylphenyl)-6-phenyl-imidazo[2,1-b]thiazole
  • 2,3-dimethyl-5-(4-methylsulfonylphenyl)-6-phenylimidazo[2,1-b]thiazole
  • 2,3-dimethyl-5-(4-methylsulfonylphenyl)-6-phenyl-imidazo[2,1-b][1,3]thiazole
  • 5-(4-mesylphenyl)-2,3-dimethyl-6-phenyl-imidazo[2,1-b]thiazole

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) Starlite/ChEMBL No references

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
Brugia malayi Animal haem peroxidase family protein 0.0032 0.033 0.0377
Loa Loa (eye worm) latrophilin receptor protein 2 0.009 0.1454 0.1367
Brugia malayi TAR-binding protein 0.0146 0.2528 0.2888
Onchocerca volvulus 0.0345 0.6342 0.6217
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Trypanosoma brucei aldo/keto reductase, putative 0.01 0.1639 0.2585
Echinococcus granulosus aldo keto reductase family 1, member B4 0.01 0.1639 0.2376
Plasmodium falciparum flap endonuclease 1 0.003 0.0298 0.1821
Echinococcus granulosus GPCR family 2 0.009 0.1454 0.2108
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0735 0.1065
Schistosoma mansoni hypothetical protein 0.0195 0.3465 0.5464
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Mycobacterium tuberculosis Probable dehydrogenase 0.0096 0.1554 0.2451
Brugia malayi Bromodomain containing protein 0.0034 0.0367 0.042
Schistosoma mansoni hypothetical protein 0.009 0.1454 0.2293
Schistosoma mansoni hypothetical protein 0.009 0.1454 0.2293
Plasmodium falciparum glutathione reductase 0.0042 0.0525 0.3203
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.009 0.1454 0.1661
Echinococcus multilocularis GPCR, family 2 0.009 0.1454 0.2108
Toxoplasma gondii aldose reductase, putative 0.0345 0.6342 1
Leishmania major prostaglandin f synthase, putative 0.0345 0.6342 1
Plasmodium vivax flap endonuclease 1, putative 0.003 0.0298 0.1821
Echinococcus granulosus tumor protein p63 0.0375 0.6899 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0106 0.1759 0.2129
Entamoeba histolytica hypothetical protein 0.0042 0.0518 0.0364
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0519 0.0819
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0015 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0068 0.1017 0.085
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0735 0.1065
Brugia malayi Thioredoxin reductase 0.0042 0.0525 0.06
Trichomonas vaginalis flap endonuclease-1, putative 0.003 0.0298 0.0298
Mycobacterium tuberculosis Conserved protein 0.0042 0.0519 0.0819
Trichomonas vaginalis alcohol dehydrogenase, putative 0.01 0.1639 0.1639
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Trypanosoma cruzi aldo/keto reductase, putative 0.0345 0.6342 1
Plasmodium vivax SET domain protein, putative 0.0068 0.1017 0.6204
Loa Loa (eye worm) hypothetical protein 0.009 0.1454 0.1367
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0068 0.1017 0.1603
Schistosoma mansoni peroxidasin 0.0032 0.033 0.052
Leishmania major trypanothione reductase 0.0042 0.0525 0.0828
Trypanosoma brucei hypothetical protein, conserved 0.0042 0.0519 0.0819
Brugia malayi Blistered cuticle protein 3 0.0032 0.033 0.0377
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0519 0.0519
Loa Loa (eye worm) MH2 domain-containing protein 0.0138 0.2366 0.2446
Brugia malayi NADH-dependent xylose reductase 0.01 0.1639 0.1873
Loa Loa (eye worm) animal heme peroxidase 0.0032 0.033 0.0037
Toxoplasma gondii ABC1 family protein 0.0042 0.0519 0.0819
Schistosoma mansoni hypothetical protein 0.009 0.1454 0.2293
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0345 0.6342 0.6342
Schistosoma mansoni tar DNA-binding protein 0.0146 0.2528 0.3986
Brugia malayi Animal haem peroxidase family protein 0.0032 0.033 0.0377
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0735 0.1065
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0042 0.0519 0.0819
Trichomonas vaginalis esterase, putative 0.0042 0.0519 0.0519
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.009 0.1454 0.2108
Onchocerca volvulus 0.0055 0.0772 0.0457
Brugia malayi jmjC domain containing protein 0.0041 0.0503 0.0575
Schistosoma mansoni pol-related 0.0345 0.6342 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0345 0.6342 0.7246
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0015 0 0.5
Mycobacterium leprae Possible oxidoreductase 0.01 0.1639 0.1924
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Trypanosoma cruzi aldo-keto reductase 0.0345 0.6342 1
Loa Loa (eye worm) oxidoreductase 0.0345 0.6342 0.7149
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0345 0.6342 1
Schistosoma mansoni tar DNA-binding protein 0.0146 0.2528 0.3986
Loa Loa (eye worm) oxidoreductase 0.0345 0.6342 0.7149
Loa Loa (eye worm) animal heme peroxidase 0.0032 0.033 0.0037
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.011 0.1837 0.2662
Mycobacterium tuberculosis Probable esterase LipL 0.0042 0.0519 0.0819
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Toxoplasma gondii aldo-keto reductase 0.01 0.1639 0.2585
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0345 0.6342 1
Loa Loa (eye worm) oxidoreductase 0.0345 0.6342 0.7149
Echinococcus granulosus aldo keto reductase 0.0345 0.6342 0.9193
Brugia malayi PHD-finger family protein 0.0034 0.0367 0.042
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.0518 0.0752
Plasmodium falciparum phd finger protein, putative 0.0034 0.0367 0.2241
Mycobacterium tuberculosis Probable oxidoreductase 0.0106 0.1759 0.2774
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0735 0.1159
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0106 0.1759 0.2774
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0519 0.0519
Brugia malayi Peroxidasin 0.0032 0.033 0.0377
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Plasmodium vivax glutathione reductase, putative 0.0042 0.0525 0.3203
Leishmania major aldo-keto reductase-like protein 0.0345 0.6342 1
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1639 0.1639
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0068 0.1017 0.1474
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0096 0.1554 0.2451
Plasmodium vivax thioredoxin reductase, putative 0.0042 0.0525 0.3203
Echinococcus multilocularis aldo keto reductase 0.0345 0.6342 0.9193
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0519 0.0519
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.01 0.1639 0.2585
Echinococcus granulosus hypothetical protein 0.0345 0.6342 0.9193
Onchocerca volvulus 0.01 0.1639 0.1354
Brugia malayi beta-lactamase family protein 0.0042 0.0519 0.0593
Plasmodium falciparum thioredoxin reductase 0.0042 0.0525 0.3203
Brugia malayi hypothetical protein 0.0042 0.0518 0.0592
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0735 0.1065
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.003 0.0298 0.0471
Loa Loa (eye worm) beta-lactamase 0.0042 0.0519 0.0261
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Brugia malayi Latrophilin receptor protein 2 0.009 0.1454 0.1661
Echinococcus multilocularis voltage gated potassium channel subunit 0.01 0.1639 0.2376
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0286 0.5197 0.5795
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0345 0.6342 1
Mycobacterium tuberculosis Probable reductase 0.0096 0.1554 0.2451
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Mycobacterium tuberculosis Conserved protein 0.0042 0.0519 0.0819
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0042 0.0519 0.0593
Loa Loa (eye worm) PHD-finger family protein 0.0034 0.0367 0.0082
Giardia lamblia Aldose reductase 0.0345 0.6342 1
Echinococcus multilocularis peregrin 0.0034 0.0367 0.0532
Onchocerca volvulus 0.0345 0.6342 0.6217
Plasmodium vivax hypothetical protein, conserved 0.0042 0.0519 0.3167
Brugia malayi beta-lactamase 0.0042 0.0519 0.0593
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0096 0.1554 0.1778
Plasmodium falciparum aldo-keto reductase, putative 0.01 0.1639 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Echinococcus granulosus peroxidasin 0.0032 0.033 0.0478
Loa Loa (eye worm) TAR-binding protein 0.0146 0.2528 0.2637
Schistosoma mansoni hypothetical protein 0.0042 0.0518 0.0818
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Mycobacterium tuberculosis Probable hydrolase 0.0042 0.0519 0.0819
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.01 0.1639 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0068 0.1017 0.1474
Giardia lamblia Aldose reductase 0.0345 0.6342 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Schistosoma mansoni tar DNA-binding protein 0.0146 0.2528 0.3986
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Giardia lamblia PHD finger protein 15 0.0034 0.0367 0.0579
Echinococcus granulosus tar DNA binding protein 0.0146 0.2528 0.3664
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0042 0.0519 0.0819
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0096 0.1554 0.2451
Echinococcus granulosus histone lysine methyltransferase setb 0.0068 0.1017 0.1474
Trichomonas vaginalis penicillin-binding protein, putative 0.0042 0.0519 0.0519
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Entamoeba histolytica aldose reductase, putative 0.0345 0.6342 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0032 0.033 0.0037
Plasmodium vivax aldehyde reductase, putative 0.01 0.1639 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Schistosoma mansoni potassium channel beta 0.01 0.1639 0.2585
Echinococcus granulosus flap endonuclease 1 0.003 0.0298 0.0433
Echinococcus multilocularis thioredoxin glutathione reductase 0.0042 0.0536 0.0777
Echinococcus multilocularis tumor protein p63 0.0375 0.6899 1
Loa Loa (eye worm) animal heme peroxidase 0.0032 0.033 0.0037
Toxoplasma gondii thioredoxin reductase 0.0042 0.0525 0.0828
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0345 0.6342 0.6342
Echinococcus granulosus aldo keto reductase 0.0345 0.6342 0.9193
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0096 0.1554 0.2451
Echinococcus multilocularis lysine specific demethylase 5A 0.0041 0.0503 0.0729
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.011 0.1837 0.2662
Giardia lamblia Flap structure-specific endonuclease 0.003 0.0298 0.0471
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1639 0.1639
Loa Loa (eye worm) hypothetical protein 0.0286 0.5197 0.5795
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0286 0.5197 0.5938
Schistosoma mansoni tar DNA-binding protein 0.0146 0.2528 0.3986
Trypanosoma cruzi aldo/keto reductase, putative 0.01 0.1639 0.2585
Echinococcus multilocularis beta LACTamase domain containing family member 0.0042 0.0519 0.0752
Onchocerca volvulus 0.0345 0.6342 0.6217
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Brugia malayi Flap endonuclease-1 0.003 0.0298 0.0341
Echinococcus multilocularis flap endonuclease 1 0.003 0.0298 0.0433
Echinococcus granulosus aldo keto reductase 0.0345 0.6342 0.9193
Onchocerca volvulus 0.0042 0.0519 0.0196
Loa Loa (eye worm) hypothetical protein 0.0195 0.3465 0.3746
Mycobacterium tuberculosis Probable oxidoreductase 0.0345 0.6342 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.003 0.0298 0.0471
Echinococcus multilocularis aldehyde reductase 0.0245 0.4424 0.6413
Onchocerca volvulus 0.0042 0.0519 0.0196
Trypanosoma cruzi trypanothione reductase, putative 0.0042 0.0525 0.0828
Brugia malayi Animal haem peroxidase family protein 0.0032 0.033 0.0377
Onchocerca volvulus 0.0042 0.0519 0.0196
Toxoplasma gondii PHD-finger domain-containing protein 0.0034 0.0367 0.0579
Brugia malayi Calcitonin receptor-like protein seb-1 0.0286 0.5197 0.5938
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Onchocerca volvulus 0.0345 0.6342 0.6217
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0034 0.0367 0.0579
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Mycobacterium ulcerans hypothetical protein 0.0042 0.0519 0.0819
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.0503 0.0242
Schistosoma mansoni aldo-keto reductase 0.0345 0.6342 1
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0015 0 0.5
Brugia malayi Pre-SET motif family protein 0.0471 0.8752 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0042 0.0525 0.0828
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0503 0.0794
Plasmodium vivax hypothetical protein, conserved 0.0034 0.0367 0.2241
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Brugia malayi jmjC domain containing protein 0.011 0.1837 0.2098
Loa Loa (eye worm) RNA binding protein 0.0146 0.2528 0.2637
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Entamoeba histolytica hypothetical protein 0.0042 0.0518 0.0364
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0735 0.1159
Trypanosoma brucei prostaglandin f synthase 0.0345 0.6342 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0345 0.6342 0.9193
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0345 0.6342 0.7246
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Trichomonas vaginalis conserved hypothetical protein 0.01 0.1639 0.1639
Brugia malayi RNA binding protein 0.0146 0.2528 0.2888
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Entamoeba histolytica hypothetical protein 0.0042 0.0518 0.0364
Brugia malayi glutamate-cysteine ligase modifier subunit 0.01 0.1639 0.1873
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0106 0.1759 0.2774
Schistosoma mansoni tar DNA-binding protein 0.0146 0.2528 0.3986
Brugia malayi Animal haem peroxidase family protein 0.0032 0.033 0.0377
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.009 0.1454 0.2108
Echinococcus multilocularis PHD finger protein rhinoceros 0.0034 0.0367 0.0532
Onchocerca volvulus 0.0345 0.6342 0.6217
Treponema pallidum NADH oxidase 0.0015 0 0.5
Echinococcus granulosus peregrin 0.0034 0.0367 0.0532
Brugia malayi glutathione reductase 0.0042 0.0525 0.06
Mycobacterium ulcerans oxidoreductase 0.0345 0.6342 1
Echinococcus granulosus lysine specific demethylase 5A 0.0041 0.0503 0.0729
Trypanosoma brucei aldo-keto reductase, putative 0.0345 0.6342 1
Echinococcus multilocularis jumonji domain containing protein 0.0047 0.062 0.0899
Loa Loa (eye worm) hypothetical protein 0.0055 0.0772 0.056
Echinococcus multilocularis aldo keto reductase 0.0345 0.6342 0.9193
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0471 0.8752 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0345 0.6342 0.6342
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Mycobacterium tuberculosis Probable lipase LipD 0.0042 0.0519 0.0819
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0266 0.4817 0.7595
Echinococcus multilocularis peroxidasin 0.0032 0.033 0.0478
Loa Loa (eye worm) jmjC domain-containing protein 0.007 0.1055 0.0895
Schistosoma mansoni hypothetical protein 0.0034 0.0367 0.0579
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0068 0.1017 0.1603
Mycobacterium ulcerans beta-lactamase 0.0042 0.0519 0.0819
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0042 0.0519 0.0819
Echinococcus granulosus aldehyde reductase 0.0245 0.4424 0.6413
Trichomonas vaginalis aldo/keto reductase, putative 0.0345 0.6342 0.6342
Trichomonas vaginalis aldo/keto reductase, putative 0.0345 0.6342 0.6342
Loa Loa (eye worm) oxidoreductase 0.0345 0.6342 0.7149
Echinococcus granulosus jumonji domain containing protein 0.0047 0.062 0.0899
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0068 0.1017 0.1603
Brugia malayi latrophilin 2 splice variant baaae 0.0195 0.3465 0.3959
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.009 0.1454 0.2108
Loa Loa (eye worm) hypothetical protein 0.0345 0.6342 0.7149
Mycobacterium ulcerans esterase/lipase LipP 0.0042 0.0519 0.0819
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0519 0.0819
Entamoeba histolytica aldose reductase, putative 0.0345 0.6342 1
Onchocerca volvulus Alhambra homolog 0.0034 0.0367 0.0039
Brugia malayi Pre-SET motif family protein 0.0068 0.1017 0.1162
Toxoplasma gondii PHD-finger domain-containing protein 0.0034 0.0367 0.0579
Brugia malayi hypothetical protein 0.0032 0.033 0.0377
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0068 0.1017 0.1603
Entamoeba histolytica alcohol dehydrogenase, putative 0.01 0.1639 0.2219
Loa Loa (eye worm) hypothetical protein 0.0058 0.0829 0.0627
Leishmania major flap endonuclease-1 (FEN-1), putative 0.003 0.0298 0.0471
Trichomonas vaginalis aldo/keto reductase, putative 0.0345 0.6342 0.6342
Echinococcus multilocularis tar DNA binding protein 0.0146 0.2528 0.3664
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.01 0.1639 0.2585
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0068 0.1017 0.1603
Schistosoma mansoni hypothetical protein 0.009 0.1454 0.2293
Mycobacterium tuberculosis Probable lipase LipE 0.0042 0.0519 0.0819
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0042 0.0519 0.0261
Brugia malayi MH2 domain containing protein 0.0138 0.2366 0.2703
Onchocerca volvulus 0.0068 0.1017 0.071
Brugia malayi beta-lactamase family protein 0.0042 0.0519 0.0593
Loa Loa (eye worm) oxidoreductase 0.0345 0.6342 0.7149
Entamoeba histolytica aldose reductase, putative 0.0345 0.6342 1
Mycobacterium ulcerans hypothetical protein 0.01 0.1639 0.2585
Echinococcus multilocularis aldo keto reductase 0.0345 0.6342 0.9193
Schistosoma mansoni jumonji domain containing protein 0.0088 0.1402 0.2211
Onchocerca volvulus 0.0345 0.6342 0.6217
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.0518 0.0752
Schistosoma mansoni cellular tumor antigen P53 0.0055 0.0772 0.1217
Leishmania major hypothetical protein, conserved 0.0042 0.0519 0.0819
Trypanosoma brucei trypanothione reductase 0.0042 0.0525 0.0828
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0519 0.0819
Echinococcus granulosus beta LACTamase domain containing family member 0.0042 0.0519 0.0752
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.003 0.0298 0.0471
Mycobacterium leprae Conserved hypothetical protein 0.0245 0.4424 0.6707
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0096 0.1554 0.2451
Loa Loa (eye worm) glutathione reductase 0.0042 0.0525 0.0268
Entamoeba histolytica alcohol dehydrogenase, putative 0.01 0.1639 0.2219
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.0735 0.0516
Echinococcus granulosus PHD finger protein rhinoceros 0.0034 0.0367 0.0532
Brugia malayi RNA recognition motif domain containing protein 0.0146 0.2528 0.2888
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0503 0.0794
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.0735 0.084
Mycobacterium ulcerans lipase LipD 0.0042 0.0519 0.0819
Brugia malayi Animal haem peroxidase family protein 0.0032 0.033 0.0377
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.0518 0.0818
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0345 0.6342 0.7246
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Loa Loa (eye worm) thioredoxin reductase 0.0042 0.0525 0.0268
Schistosoma mansoni flap endonuclease-1 0.0027 0.0243 0.0383
Echinococcus multilocularis aldo keto reductase 0.0345 0.6342 0.9193
Schistosoma mansoni peroxidasin 0.0032 0.033 0.052
Trichomonas vaginalis aldo-keto reductase, putative 0.01 0.1639 0.1639
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Loa Loa (eye worm) hypothetical protein 0.0032 0.033 0.0037
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0345 0.6342 0.7246
Mycobacterium tuberculosis Conserved protein 0.01 0.1639 0.2585
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0735 0.1159
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0065 0.0969 0.1405
Echinococcus granulosus voltage gated potassium channel subunit 0.01 0.1639 0.2376
Schistosoma mansoni aldo-keto reductase 0.0345 0.6342 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.009 0.1454 0.2108
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Trichomonas vaginalis set domain proteins, putative 0.0536 1 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0519 0.0261
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0345 0.6342 0.9193
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0146 0.2528 0.2637
Trichomonas vaginalis D-aminoacylase, putative 0.0042 0.0519 0.0519
Plasmodium falciparum aldehyde reductase, putative 0.01 0.1639 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0345 0.6342 0.6342
Loa Loa (eye worm) transcription factor SMAD2 0.0138 0.2366 0.2446
Loa Loa (eye worm) hypothetical protein 0.0034 0.0367 0.0082
Echinococcus granulosus thioredoxin glutathione reductase 0.0042 0.0536 0.0777
Mycobacterium tuberculosis Conserved protein 0.0042 0.0519 0.0819
Loa Loa (eye worm) animal heme peroxidase 0.0032 0.033 0.0037
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0042 0.0519 0.0819
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.01 0.1639 0.1586
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.01 0.1639 0.2585
Entamoeba histolytica hypothetical protein 0.0042 0.0518 0.0364
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0042 0.0519 0.0819

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 5 uM In vitro inhibition of the production of PGE-2 in arachidonic acid stimulated chinese hamster ovary (CHO) cellstransfected with human cyclooxygenase-2 ChEMBL. No reference
IC50 (binding) = 5 uM In vitro inhibition of the production of PGE-2 in arachidonic acid stimulated chinese hamster ovary (CHO) cellstransfected with human cyclooxygenase-2 ChEMBL. No reference
IC50 (binding) > 50 uM In vitro inhibition of the production of PGE-2 in arachidonic acid stimulated chinese hamster ovary (CHO) cellstransfected with human cyclooxygenase-1 ChEMBL. No reference
IC50 (binding) > 50 uM In vitro inhibition of the production of PGE-2 in arachidonic acid stimulated chinese hamster ovary (CHO) cellstransfected with human cyclooxygenase-1 ChEMBL. No reference

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

No literature references available for this target.

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