Detailed information for compound 756586

Basic information

Technical information
  • TDR Targets ID: 756586
  • Name: 4-[5-[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxop yrazol-4-ylidene]methyl]furan-2-yl]benzenesul fonamide
  • MW: 421.469 | Formula: C22H19N3O4S
  • H donors: 1 H acceptors: 3 LogP: 3.09 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)N1N=C(C(=Cc2ccc(o2)c2ccc(cc2)S(=O)(=O)N)C1=O)C
  • InChi: 1S/C22H19N3O4S/c1-14-3-7-17(8-4-14)25-22(26)20(15(2)24-25)13-18-9-12-21(29-18)16-5-10-19(11-6-16)30(23,27)28/h3-13H,1-2H3,(H2,23,27,28)/b20-13-
  • InChiKey: FRNJJHIJSKNWFM-MOSHPQCFSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-[5-[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-pyrazol-4-ylidene]methyl]-2-furyl]benzenesulfonamide
  • 4-[5-[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-4-pyrazolylidene]methyl]-2-furyl]benzenesulfonamide
  • 4-[5-[(Z)-[5-keto-3-methyl-1-(4-methylphenyl)pyrazol-4-ylidene]methyl]-2-furyl]benzenesulfonamide
  • 4-[5-[(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-pyrazol-4-ylidene]methyl]furan-2-yl]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
Echinococcus multilocularis hexokinase type 2 0.008 0.0175 0.6629
Trypanosoma cruzi hexokinase, putative 0.008 0.0175 0.6529
Brugia malayi PHD-finger family protein 0.0025 0.0013 0.0011
Echinococcus multilocularis ubiquitin conjugating enzyme e2 i 0.0025 0.0013 0.0287
Schistosoma mansoni hypothetical protein 0.0029 0.0025 0.0233
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0075 0.0848
Echinococcus granulosus sumo-activating enzyme subunit 2 0.0032 0.0033 0.1065
Loa Loa (eye worm) hypothetical protein 0.0025 0.0014 0.0186
Schistosoma mansoni bromodomain containing protein 0.0063 0.0127 0.1166
Brugia malayi Hexokinase family protein 0.005 0.0087 0.1018
Loa Loa (eye worm) glutaminase 0.0274 0.075 1
Echinococcus granulosus ubiquitin conjugating enzyme e2 i 0.0025 0.0013 0.0287
Loa Loa (eye worm) hypothetical protein 0.0071 0.0149 0.1982
Loa Loa (eye worm) hexokinase 0.008 0.0175 0.2335
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0075 0.0686
Echinococcus granulosus 6 phosphofructokinase 0.0109 0.0261 1
Echinococcus multilocularis SUMO activating enzyme subunit 1 0.0048 0.0082 0.2979
Echinococcus granulosus lysine specific demethylase 5A 0.0037 0.0049 0.1701
Mycobacterium ulcerans glutaminase 0.0274 0.075 0.6453
Loa Loa (eye worm) hexokinase 0.005 0.0087 0.1161
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0109 0.0261 0.2222
Loa Loa (eye worm) glutaminase 2 0.0274 0.075 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0045 0.1554
Loa Loa (eye worm) ube2i2 protein 0.0025 0.0013 0.0173
Onchocerca volvulus Hexokinase homolog 0.005 0.0087 0.4122
Mycobacterium leprae RECA PROTEIN (RECOMBINASE A) [CONTAINS: Mle RECA INTEIN]. 0.0108 0.0259 0.0376
Loa Loa (eye worm) PHD-finger family protein 0.0029 0.0025 0.0337
Echinococcus granulosus dynactin 5 p25 0.007 0.0148 0.5545
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0075 0.2693
Loa Loa (eye worm) jmjC domain-containing protein 0.0037 0.0049 0.0655
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0109 0.0261 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0075 0.2693
Plasmodium vivax SUMO-activating enzyme subunit 2, putative 0.0032 0.0033 0.1227
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0025 0.0767
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0029 0.0026 0.0797
Trypanosoma brucei hexokinase 0.008 0.0175 0.6529
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.0261 1
Trypanosoma cruzi hexokinase, putative 0.008 0.0175 0.6529
Onchocerca volvulus 0.0068 0.014 0.7622
Loa Loa (eye worm) hexokinase 0.0025 0.0012 0.0159
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0075 0.2693
Brugia malayi Bromodomain containing protein 0.0038 0.0052 0.0549
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Trypanosoma cruzi DNA repair protein, putative 0.0033 0.0037 0.0981
Brugia malayi glutaminase DH11.1 0.0274 0.075 1
Plasmodium falciparum SUMO-activating enzyme subunit 1 0.0048 0.0082 0.4245
Loa Loa (eye worm) hypothetical protein 0.0054 0.01 0.1333
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0026 0.0797
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Brugia malayi Bromodomain containing protein 0.0075 0.0161 0.2025
Schistosoma mansoni sumo-1-activating enzyme E1a 0.0048 0.0082 0.0754
Leishmania major ATP-dependent phosphofructokinase 0.0109 0.0261 1
Plasmodium vivax hexokinase, putative 0.008 0.0175 1
Brugia malayi ThiF family protein 0.0032 0.0033 0.0284
Leishmania major ubiquitin-activating enzyme-like protein 0.0032 0.0033 0.0801
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0075 0.2693
Schistosoma mansoni 6-phosphofructokinase 0.0109 0.0261 0.2407
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Entamoeba histolytica ankyrin, putative 0.007 0.0148 0.5414
Loa Loa (eye worm) hexokinase type II 0.008 0.0175 0.2335
Echinococcus multilocularis hexokinase 0.008 0.0175 0.6629
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0096 0.0222 0.8466
Brugia malayi ThiF family protein 0.0048 0.0082 0.0947
Wolbachia endosymbiont of Brugia malayi replicative DNA helicase 0.0387 0.1086 1
Schistosoma mansoni 6-phosphofructokinase 0.0109 0.0261 0.2407
Loa Loa (eye worm) hypothetical protein 0.0048 0.0082 0.1091
Loa Loa (eye worm) hypothetical protein 0.0025 0.0014 0.0186
Leishmania major hexokinase, putative 0.008 0.0175 0.6529
Schistosoma mansoni ubiquitin-activating enzyme E1b 0.0032 0.0033 0.0303
Leishmania major hexokinase, putative 0.008 0.0175 0.6529
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0075 0.0993
Trichomonas vaginalis glutaminase, putative 0.0274 0.075 1
Trypanosoma brucei ubiquitin-activating enzyme E1, putative 0.0032 0.0033 0.0801
Toxoplasma gondii 6-phosphofructokinase 0.0029 0.0026 0.0797
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.0261 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0075 0.0686
Echinococcus granulosus peregrin 0.0032 0.0032 0.1042
Schistosoma mansoni hexokinase 0.008 0.0175 0.1613
Loa Loa (eye worm) hexokinase 0.008 0.0175 0.2335
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0026 0.0797
Echinococcus multilocularis SUMO activating enzyme subunit 2 0.0032 0.0033 0.1065
Echinococcus multilocularis lysine specific demethylase 5A 0.0035 0.0044 0.1479
Toxoplasma gondii hexokinase 0.008 0.0175 1
Trypanosoma brucei hexokinase 0.008 0.0175 0.6529
Schistosoma mansoni ubiquitin-conjugating enzyme E2 I 0.0025 0.0013 0.012
Brugia malayi Bromodomain containing protein 0.0032 0.0032 0.0276
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0075 0.0686
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.0116 0.4313
Echinococcus multilocularis 6 phosphofructokinase 0.0109 0.0261 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0025 0.0758
Plasmodium falciparum phd finger protein, putative 0.0029 0.0025 0.0758
Treponema pallidum recombinase A 0.0108 0.0259 0.22
Brugia malayi Hexokinase family protein 0.008 0.0175 0.2212
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0006 0.0052
Loa Loa (eye worm) hypothetical protein 0.005 0.0087 0.1161
Loa Loa (eye worm) hypothetical protein 0.0043 0.0065 0.0871
Entamoeba histolytica acetyltransferase, putative 0.007 0.0148 0.5414
Schistosoma mansoni sumo-1-activating enzyme E1a 0.0044 0.0069 0.0633
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0109 0.0261 1
Trypanosoma cruzi ubiquitin-activating enzyme, putative 0.0027 0.002 0.0272
Loa Loa (eye worm) hypothetical protein 0.0038 0.0053 0.0702
Echinococcus granulosus SUMO activating enzyme subunit 1 0.0048 0.0082 0.2979
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.0261 0.337
Brugia malayi jmjC domain containing protein 0.0037 0.0049 0.0505
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0029 0.0026 0.052
Brugia malayi hexokinase 0.008 0.0175 0.2212
Plasmodium falciparum hexokinase 0.008 0.0175 1
Trypanosoma cruzi DNA repair protein, putative 0.0033 0.0037 0.0981
Echinococcus granulosus hexokinase 0.008 0.0175 0.6629
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0049 0.0453
Entamoeba histolytica hexokinase 1 0.008 0.0175 0.6529
Onchocerca volvulus 0.008 0.0175 1
Treponema pallidum hexokinase (hxk) 0.008 0.0175 0.1408
Schistosoma mansoni Replicative DNA helicase 0.0387 0.1086 1
Loa Loa (eye worm) ThiF family protein 0.0032 0.0033 0.0439
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0045 0.1554
Brugia malayi hexokinase type II 0.0025 0.0014 0.0027
Trypanosoma cruzi ubiquitin-activating enzyme, putative 0.0032 0.0033 0.0801
Plasmodium vivax 6-phosphofructokinase, putative 0.0029 0.0026 0.0797
Giardia lamblia PHD finger protein 15 0.0029 0.0025 0.9513
Mycobacterium tuberculosis RecA protein (recombinase A) [contains: endonuclease PI-MTUI (MTU RecA intein)]. 0.3116 0.9173 0.9161
Echinococcus granulosus hexokinase 0.008 0.0175 0.6629
Echinococcus multilocularis peregrin 0.0032 0.0032 0.1042
Mycobacterium ulcerans 6-phosphofructokinase 0.0109 0.0261 0.1288
Wolbachia endosymbiont of Brugia malayi recombinase A 0.0108 0.0259 0.1189
Brugia malayi phosphofructokinase 0.0109 0.0261 0.3379
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.0261 0.337
Trypanosoma brucei hexokinase, putative 0.008 0.0175 0.6529
Onchocerca volvulus 0.008 0.0175 1
Brugia malayi jmjC domain containing protein 0.0096 0.0222 0.2848
Toxoplasma gondii PHD-finger domain-containing protein 0.0029 0.0025 0.0758
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Loa Loa (eye worm) 6-phosphofructokinase 0.0109 0.0261 0.3485
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0096 0.0222 0.8466
Echinococcus multilocularis hexokinase 0.008 0.0175 0.6629
Brugia malayi 6-phosphofructokinase 0.0109 0.0261 0.3379
Schistosoma mansoni glutaminase 0.0274 0.075 0.6909
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0109 0.0261 0.0116
Plasmodium falciparum SUMO-activating enzyme subunit 2 0.0032 0.0033 0.1227
Loa Loa (eye worm) hypothetical protein 0.0029 0.0025 0.0337
Loa Loa (eye worm) 6-phosphofructokinase 0.0109 0.0261 0.3485
Loa Loa (eye worm) jmjC domain-containing protein 0.006 0.0117 0.1565
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0029 0.0026 1
Loa Loa (eye worm) phosphofructokinase 0.0109 0.0261 0.3485
Schistosoma mansoni jumonji domain containing protein 0.0076 0.0164 0.151
Onchocerca volvulus 0.008 0.0175 1
Trypanosoma brucei recA bacterial DNA recombination protein, putative 0.0033 0.0037 0.0981
Brugia malayi ube2i2 protein 0.0025 0.0013 0.0015
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0029 0.0025 0.0233
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0059 0.2093
Schistosoma mansoni jumonji/arid domain-containing protein 0.0037 0.0049 0.0453
Brugia malayi 6-phosphofructokinase 0.0109 0.0261 0.3379
Echinococcus multilocularis hexokinase 0.008 0.0175 0.6629
Echinococcus multilocularis PHD finger protein rhinoceros 0.0029 0.0025 0.0767
Trichomonas vaginalis phosphofructokinase, putative 0.0029 0.0026 0.0175
Onchocerca volvulus 0.005 0.0087 0.4122
Toxoplasma gondii hypothetical protein 0.0048 0.0082 0.4245
Treponema pallidum replicative DNA helicase (dnaB) 0.0387 0.1086 1
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0059 0.2093
Toxoplasma gondii ThiF family protein 0.0032 0.0033 0.1227
Loa Loa (eye worm) twinkle helicase 0.0111 0.0267 0.3552
Plasmodium vivax hypothetical protein, conserved 0.0029 0.0025 0.0758
Mycobacterium leprae PROBABLE REPLICATIVE DNA HELICASE DNAB replicative DNA helicase 0.0387 0.1086 0.2975
Toxoplasma gondii phosphofructokinase PFKII 0.0029 0.0026 0.0797
Echinococcus granulosus hexokinase 0.008 0.0175 0.6629
Mycobacterium ulcerans replicative DNA helicase DnaB 0.0387 0.1086 1
Mycobacterium leprae Conserved hypothetical protein 0.1141 0.3321 1
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0029 0.0026 0.0175
Loa Loa (eye worm) hypothetical protein 0.0041 0.006 0.0795
Entamoeba histolytica phosphofructokinase, putative 0.0109 0.0261 1
Brugia malayi PHD-finger family protein 0.0029 0.0025 0.0181
Trichomonas vaginalis maltose O-acetyltransferase, putative 0.0068 0.014 0.1717
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0029 0.0026 0.0797
Echinococcus granulosus hexokinase type 2 0.008 0.0175 0.6629
Chlamydia trachomatis recombinase RecA 0.0108 0.0259 0.22
Mycobacterium tuberculosis Conserved hypothetical protein 0.0872 0.2523 0.2411
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.0261 0.337
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0109 0.0261 0.0383
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.0116 0.4313
Trichomonas vaginalis conserved hypothetical protein 0.0068 0.014 0.1717
Chlamydia trachomatis replicative DNA helicase 0.0387 0.1086 1
Trichomonas vaginalis phosphofructokinase, putative 0.0109 0.0261 0.337
Mycobacterium ulcerans recombinase A 0.0108 0.0259 0.1263
Plasmodium vivax ubiquitin activating enzyme, putative 0.0048 0.0082 0.4245
Entamoeba histolytica hexokinase 2 0.008 0.0175 0.6529

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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