Detailed information for compound 701686

Basic information

Technical information
  • TDR Targets ID: 701686
  • Name: ethyl 1-(2-chlorophenyl)-4-(4-methoxyphenyl)s ulfonyloxy-6-oxopyridazine-3-carboxylate
  • MW: 464.876 | Formula: C20H17ClN2O7S
  • H donors: 0 H acceptors: 4 LogP: 3.57 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)c1nn(c(=O)cc1OS(=O)(=O)c1ccc(cc1)OC)c1ccccc1Cl
  • InChi: 1S/C20H17ClN2O7S/c1-3-29-20(25)19-17(30-31(26,27)14-10-8-13(28-2)9-11-14)12-18(24)23(22-19)16-7-5-4-6-15(16)21/h4-12H,3H2,1-2H3
  • InChiKey: LZSLYFNHFRNLAA-UHFFFAOYSA-N  

Network

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Synonyms

  • ethyl 1-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxo-pyridazine-3-carboxylate
  • 1-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonyloxy-6-oxo-3-pyridazinecarboxylic acid ethyl ester
  • 1-(2-chlorophenyl)-6-keto-4-(4-methoxyphenyl)sulfonyloxy-pyridazine-3-carboxylic acid ethyl ester

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
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0109 0.1446 1
Mycobacterium tuberculosis Conserved protein 0.0073 0.0936 0.1253
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0202 0.0938
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0169 0.0325
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0169 0.2375
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0306 0.0298
Leishmania major GTP-binding protein, putative 0.0021 0.0202 0.0576
Loa Loa (eye worm) hypothetical protein 0.0015 0.0126 0.0217
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0812 0.0804
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0812 0.0804
Schistosoma mansoni ferritin 0.0017 0.0144 0.0136
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0126 0.0217
Trypanosoma brucei hypothetical protein, conserved 0.0073 0.0936 0.6134
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.074 0.1649
Leishmania major hypothetical protein, conserved 0.0073 0.0936 0.6134
Trypanosoma brucei calpain-like protein, putative 0.0109 0.1446 1
Echinococcus granulosus snurportin 1 0.0301 0.4133 0.4128
Toxoplasma gondii ABC1 family protein 0.0073 0.0936 1
Echinococcus multilocularis protein quaking 0.0027 0.0284 0.0276
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Entamoeba histolytica hypothetical protein 0.0023 0.0231 0.2341
Echinococcus granulosus tar DNA binding protein 0.0064 0.0812 0.0804
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0812 0.1817
Entamoeba histolytica hypothetical protein 0.0037 0.0437 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0202 0.0576
Echinococcus granulosus importin subunit beta 1 0.0028 0.0306 0.0298
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0109 0.1446 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0466 0.6458 1
Echinococcus granulosus phd:f box containing protein 0.0015 0.0126 0.0117
Brugia malayi hypothetical protein 0.0027 0.0284 0.059
Echinococcus multilocularis beta LACTamase domain containing family member 0.0073 0.0936 0.0928
Echinococcus granulosus muscleblind protein 0.0146 0.196 0.1953
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0936 0.0928
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0109 0.1446 1
Echinococcus granulosus jumonji domain containing 1A 0.0015 0.0126 0.0117
Mycobacterium ulcerans esterase/lipase LipP 0.0073 0.0936 1
Echinococcus multilocularis JmjC domain containing protein 4 0.0015 0.0126 0.0117
Echinococcus granulosus dnaJ subfamily B 0.04 0.5521 0.5518
Schistosoma mansoni hypothetical protein 0.0037 0.0437 0.0429
Echinococcus multilocularis lysine specific demethylase 6a 0.0015 0.0126 0.0117
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0169 0.1804
Echinococcus granulosus expressed protein 0.0017 0.0144 0.0136
Schistosoma mansoni phosphatidylserine receptor 0.0015 0.0126 0.0117
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0812 0.182
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0812 0.0804
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0202 0.0193
Entamoeba histolytica Ran family GTPase 0.0021 0.0202 0.1236
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0202 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0169 0.0325
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Mycobacterium tuberculosis Probable lipase LipD 0.0073 0.0936 0.1253
Brugia malayi jmjC domain containing protein 0.0057 0.0718 0.16
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0202 0.0576
Schistosoma mansoni ferritin 0.0017 0.0144 0.0136
Echinococcus multilocularis expressed protein 0.0017 0.0144 0.0136
Schistosoma mansoni cpg binding protein 0.0028 0.0305 0.0296
Schistosoma mansoni cpg binding protein 0.003 0.0327 0.0319
Entamoeba histolytica hypothetical protein 0.0037 0.0437 1
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0306 0.2228
Schistosoma mansoni jumonji/arid domain-containing protein 0.0059 0.074 0.0732
Loa Loa (eye worm) hypothetical protein 0.0146 0.196 0.4493
Loa Loa (eye worm) hypothetical protein 0.0027 0.0284 0.0586
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0746 0.0738
Brugia malayi beta-lactamase family protein 0.0073 0.0936 0.2108
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0169 0.0317
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0202 0.0193
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0437 0.0429
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0057 0.0718 0.071
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0169 1
Echinococcus multilocularis muscleblind protein 0.0146 0.196 0.1953
Echinococcus multilocularis ferritin 0.0017 0.0144 0.0136
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0073 0.0936 0.2108
Loa Loa (eye worm) beta-lactamase 0.0073 0.0936 0.2105
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0437 0.0429
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0936 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0169 0.0325
Schistosoma mansoni protein phosphatase 2C 0.0015 0.0126 0.0117
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0169 0.1804
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0231 0.2474
Mycobacterium ulcerans beta-lactamase 0.0073 0.0936 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0169 0.0325
Echinococcus multilocularis muscleblind protein 1 0.0146 0.196 0.1953
Mycobacterium ulcerans hypothetical protein 0.0073 0.0936 1
Brugia malayi tumor suppressor. 0.0314 0.4322 1
Mycobacterium leprae conserved hypothetical protein 0.0073 0.0936 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0073 0.0936 1
Schistosoma mansoni cpg binding protein 0.003 0.0327 0.0319
Brugia malayi RNA binding protein 0.0064 0.0812 0.182
Schistosoma mansoni ferritin light chain 0.0017 0.0144 0.0136
Brugia malayi RNA, U transporter 1 0.008 0.1036 0.2341
Onchocerca volvulus 0.0073 0.0936 1
Onchocerca volvulus 0.0073 0.0936 1
Brugia malayi jmjC domain containing protein 0.0059 0.074 0.1652
Schistosoma mansoni apoferritin-2 0.0017 0.0144 0.0136
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0437 0.0429
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0033 0.0024
Trichomonas vaginalis ferritin, putative 0.0017 0.0144 0.1543
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0936 1
Schistosoma mansoni microtubule-associated protein tau 0.0718 1 1
Mycobacterium ulcerans lipase LipD 0.0073 0.0936 1
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0306 0.1367
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0301 0.4133 0.956
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0936 1
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Brugia malayi CXXC zinc finger family protein 0.0028 0.0305 0.0638
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0073 0.0936 0.1253
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0936 0.6134
Brugia malayi jmjC domain containing protein 0.0015 0.0126 0.0221
Schistosoma mansoni ran 0.0021 0.0202 0.0193
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Schistosoma mansoni jumonji domain containing protein 0.0057 0.0718 0.071
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0231 0.2474
Trichomonas vaginalis esterase, putative 0.0073 0.0936 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0306 0.1367
Brugia malayi TAR-binding protein 0.0064 0.0812 0.182
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0126 0.0217
Plasmodium vivax hypothetical protein, conserved 0.0073 0.0936 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0033 0.0024
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0231 0.08
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0169 1
Schistosoma mansoni ferritin 0.0017 0.0144 0.0136
Loa Loa (eye worm) hypothetical protein 0.0015 0.0126 0.0217
Schistosoma mansoni ap endonuclease 0.0018 0.0169 0.016
Echinococcus granulosus cpg binding protein 0.003 0.0327 0.0319
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0073 0.0936 0.1253
Echinococcus granulosus ferritin 0.0017 0.0144 0.0136
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0169 0.016
Brugia malayi beta-lactamase 0.0073 0.0936 0.2108
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0202 0.0938
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0812 0.0804
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.0936 1
Loa Loa (eye worm) hypothetical protein 0.0146 0.196 0.4493
Echinococcus multilocularis snurportin 1 0.0301 0.4133 0.4128
Loa Loa (eye worm) RNA binding protein 0.0064 0.0812 0.1817
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Echinococcus granulosus beta LACTamase domain containing family member 0.0073 0.0936 0.0928
Schistosoma mansoni ferritin light chain 0.0017 0.0144 0.0136
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0812 0.0804
Schistosoma mansoni ap endonuclease 0.0018 0.0169 0.016
Echinococcus granulosus hypothetical protein 0.0027 0.0284 0.0276
Trypanosoma brucei hypothetical protein 0.0109 0.1446 1
Mycobacterium tuberculosis Probable hydrolase 0.0073 0.0936 0.1253
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0231 0.2474
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0169 0.0308
Schistosoma mansoni hypothetical protein 0.0027 0.0284 0.0276
Schistosoma mansoni ferritin 0.0017 0.0144 0.0136
Loa Loa (eye worm) hypothetical protein 0.0015 0.0126 0.0217
Brugia malayi jmjC domain containing protein 0.0015 0.0126 0.0221
Mycobacterium tuberculosis Probable esterase LipL 0.0073 0.0936 0.1253
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0812 0.1817
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0202 0.4211
Trypanosoma brucei variant surface glycoprotein (VSG), putative 0.0109 0.1446 1
Mycobacterium tuberculosis Probable lipase LipE 0.0073 0.0936 0.1253
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0073 0.0936 0.1253
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.0936 0.0928
Echinococcus granulosus protein quaking 0.0027 0.0284 0.0276
Mycobacterium tuberculosis Conserved protein 0.0073 0.0936 0.1253
Brugia malayi Muscleblind-like protein 0.0146 0.196 0.4495
Trichomonas vaginalis ran, putative 0.0021 0.0202 0.2158
Echinococcus granulosus JmjC domain containing protein 4 0.0015 0.0126 0.0117
Entamoeba histolytica hypothetical protein 0.0037 0.0437 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0169 0.016
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0073 0.0936 0.2105
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0169 0.0321
Schistosoma mansoni ran 0.0021 0.0202 0.0193
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0109 0.1446 1
Brugia malayi Importin beta-1 subunit 0.0028 0.0306 0.0641
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0202 0.0398
Loa Loa (eye worm) tumor suppressor 0.0314 0.4322 1
Mycobacterium leprae Probable lipase LipE 0.0073 0.0936 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0169 0.0529
Brugia malayi jmjC domain containing protein 0.0015 0.0126 0.0221
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0812 0.0804
Echinococcus multilocularis jumonji domain containing 1A 0.0015 0.0126 0.0117
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0169 0.0039
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0017 0.0148 0.014
Schistosoma mansoni hypothetical protein 0.0027 0.0284 0.0276
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0109 0.1446 1
Echinococcus multilocularis lysine specific demethylase 5A 0.0057 0.0718 0.071
Mycobacterium tuberculosis Conserved protein 0.0073 0.0936 0.1253
Schistosoma mansoni apoferritin-2 0.0017 0.0144 0.0136
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0057 0.0718 0.071
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0657 0.6561
Schistosoma mansoni jumonji domain containing protein 0.0015 0.0126 0.0117
Echinococcus granulosus lysine specific demethylase 5A 0.0059 0.074 0.0732
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0109 0.1446 1
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0015 0.0126 0.0117
Plasmodium vivax importin-beta 2, putative 0.0028 0.0306 0.2228
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.0936 0.6134
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0202 0.0395
Schistosoma mansoni phd/f-box containing protein 0.0015 0.0126 0.0117
Leishmania major importin beta-1 subunit, putative 0.0023 0.0231 0.08
Onchocerca volvulus 0.0073 0.0936 1
Brugia malayi hypothetical protein 0.0037 0.0437 0.0945
Brugia malayi Temporarily assigned gene name protein 44 0.0027 0.0284 0.059
Schistosoma mansoni jumonji/arid domain-containing protein 0.0059 0.074 0.0732
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0109 0.1446 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0306 0.0638
Trypanosoma brucei calpain, putative 0.0109 0.1446 1
Entamoeba histolytica hypothetical protein 0.0037 0.0437 1
Echinococcus granulosus lysine specific demethylase 6a 0.0015 0.0126 0.0117
Schistosoma mansoni hypothetical protein 0.04 0.5521 0.5518
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0126 0.0217
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.0936 1
Echinococcus multilocularis dnaJ subfamily B 0.04 0.5521 0.5518
Echinococcus multilocularis phd:f box containing protein 0.0015 0.0126 0.0117
Brugia malayi beta-lactamase family protein 0.0073 0.0936 0.2108
Schistosoma mansoni importin beta-1 0.0028 0.0306 0.0298
Echinococcus multilocularis cpg binding protein 0.003 0.0327 0.0319
Toxoplasma gondii exonuclease III APE 0.0018 0.0169 0.0529
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0017 0.0148 0.014
Schistosoma mansoni hypothetical protein 0.0301 0.4133 0.4128
Plasmodium falciparum importin beta, putative 0.0028 0.0306 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0305 0.0634
Loa Loa (eye worm) hypothetical protein 0.0073 0.0936 0.2105
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0202 0.0576
Brugia malayi jmjC domain containing protein 0.0015 0.0126 0.0221
Echinococcus multilocularis microtubule associated protein 2 0.0718 1 1

Activities

No activities found for this compound.

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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