Detailed information for compound 697405

Basic information

Technical information
  • TDR Targets ID: 697405
  • Name: 1-(4-methylphenyl)-2-[(6-pyridin-3-yl-[1,2,4] triazolo[5,4-f]pyridazin-3-yl)sulfanyl]ethano ne
  • MW: 361.42 | Formula: C19H15N5OS
  • H donors: 0 H acceptors: 5 LogP: 2.95 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)C(=O)CSc1nnc2n1nc(cc2)c1cccnc1
  • InChi: 1S/C19H15N5OS/c1-13-4-6-14(7-5-13)17(25)12-26-19-22-21-18-9-8-16(23-24(18)19)15-3-2-10-20-11-15/h2-11H,12H2,1H3
  • InChiKey: SPTPCZCSFAXBAL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-(4-methylphenyl)-2-[[6-(3-pyridyl)-[1,2,4]triazolo[5,4-f]pyridazin-3-yl]sulfanyl]ethanone
  • 1-(4-methylphenyl)-2-[[6-(3-pyridyl)-[1,2,4]triazolo[5,4-f]pyridazin-3-yl]thio]ethanone
  • ZINC04377002

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
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0114 0.1024 0.1183
Loa Loa (eye worm) hypothetical protein 0.005 0.0087 0.01
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0086 0.0615 0.0639
Toxoplasma gondii ABC1 family protein 0.0114 0.1024 1
Brugia malayi latrophilin 2 splice variant baaae 0.0108 0.0932 0.295
Schistosoma mansoni tar DNA-binding protein 0.0124 0.116 0.1205
Echinococcus multilocularis GPCR, family 2 0.005 0.0087 0.009
Loa Loa (eye worm) hypothetical protein 0.006 0.023 0.0266
Brugia malayi RNA binding protein 0.0124 0.116 0.3672
Plasmodium vivax hypothetical protein, conserved 0.0114 0.1024 1
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0114 0.1024 0.0858
Leishmania major hypothetical protein, conserved 0.0073 0.0431 0.4203
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0012 0.0012
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.005 0.0087 0.0275
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.005 0.0087 0.009
Trypanosoma cruzi hypothetical protein, conserved 0.0114 0.1024 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0086 0.0615 0.5142
Schistosoma mansoni importin beta-1 0.006 0.023 0.0239
Brugia malayi Probable ClpP-like protease 0.0086 0.0615 0.1948
Schistosoma mansoni hypothetical protein 0.005 0.0087 0.009
Onchocerca volvulus 0.0114 0.1024 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0114 0.1024 0.1064
Echinococcus multilocularis snurportin 1 0.0638 0.866 0.8993
Loa Loa (eye worm) hypothetical protein 0.0049 0.0071 0.0082
Entamoeba histolytica hypothetical protein 0.0048 0.0065 1
Echinococcus granulosus importin subunit beta 1 0.006 0.023 0.0239
Brugia malayi Calcitonin receptor-like protein seb-1 0.0158 0.166 0.5255
Echinococcus multilocularis tumor protein p63 0.0334 0.4227 0.439
Schistosoma mansoni tar DNA-binding protein 0.0124 0.116 0.1205
Echinococcus multilocularis geminin 0.0704 0.9629 1
Mycobacterium leprae conserved hypothetical protein 0.0114 0.1024 1
Schistosoma mansoni hypothetical protein 0.0108 0.0932 0.0968
Schistosoma mansoni tar DNA-binding protein 0.0124 0.116 0.1205
Loa Loa (eye worm) beta-lactamase 0.0114 0.1024 0.1183
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0086 0.0615 0.5
Mycobacterium tuberculosis Conserved protein 0.0114 0.1024 0.0858
Trypanosoma brucei hypothetical protein, conserved 0.0114 0.1024 1
Loa Loa (eye worm) RNA binding protein 0.0124 0.116 0.1339
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1024 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0114 0.1024 0.0858
Echinococcus granulosus tumor protein p63 0.0334 0.4227 0.439
Brugia malayi TAR-binding protein 0.0124 0.116 0.3672
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0114 0.1024 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0114 0.1024 1
Schistosoma mansoni thyroid hormone receptor 0.0284 0.3494 0.3629
Schistosoma mansoni hypothetical protein 0.0053 0.0134 0.0139
Trichomonas vaginalis importin beta-1, putative 0.0048 0.0065 0.0637
Echinococcus granulosus lysosomal alpha glucosidase 0.0162 0.1721 0.1788
Mycobacterium tuberculosis Conserved protein 0.0114 0.1024 0.0858
Loa Loa (eye worm) hypothetical protein 0.0073 0.0431 0.0497
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0086 0.0615 0.6007
Onchocerca volvulus 0.0114 0.1024 1
Plasmodium falciparum ataxin-2 like protein, putative 0.0073 0.0431 0.6997
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.0071 0.0074
Echinococcus granulosus beta LACTamase domain containing family member 0.0114 0.1024 0.1064
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.1721 0.1788
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0162 0.1721 0.1988
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0012 0.0012
Trypanosoma cruzi hypothetical protein, conserved 0.0114 0.1024 1
Leishmania major hypothetical protein, conserved 0.0114 0.1024 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.0012 0.0012
Brugia malayi hypothetical protein 0.0261 0.3159 1
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0086 0.0615 0.5
Schistosoma mansoni hypothetical protein 0.0263 0.3187 0.3309
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0053 0.0134 0.0424
Echinococcus multilocularis beta LACTamase domain containing family member 0.0114 0.1024 0.1064
Brugia malayi Latrophilin receptor protein 2 0.005 0.0087 0.0275
Trichomonas vaginalis esterase, putative 0.0114 0.1024 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.005 0.0087 0.009
Mycobacterium tuberculosis Probable lipase LipD 0.0114 0.1024 0.0858
Mycobacterium leprae Probable lipase LipE 0.0114 0.1024 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.005 0.0087 0.01
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0012 0.0012
Mycobacterium ulcerans esterase/lipase LipP 0.0114 0.1024 1
Schistosoma mansoni hypothetical protein 0.0704 0.9629 1
Brugia malayi RNA, U transporter 1 0.017 0.1836 0.5814
Echinococcus granulosus snurportin 1 0.0638 0.866 0.8993
Onchocerca volvulus 0.0114 0.1024 1
Echinococcus multilocularis survival motor neuron protein 1 0.0261 0.3159 0.328
Echinococcus multilocularis tar DNA binding protein 0.0124 0.116 0.1205
Schistosoma mansoni hypothetical protein 0.0704 0.9629 1
Toxoplasma gondii LsmAD domain-containing protein 0.0073 0.0431 0.4203
Brugia malayi Importin beta-1 subunit 0.006 0.023 0.0728
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.005 0.0087 0.009
Plasmodium vivax ataxin-2 like protein, putative 0.0073 0.0431 0.4203
Schistosoma mansoni peptidase Clp (S14 family) 0.0086 0.0615 0.0639
Mycobacterium tuberculosis Conserved protein 0.0114 0.1024 0.0858
Plasmodium falciparum ataxin-2 like protein, putative 0.0073 0.0431 0.6997
Echinococcus granulosus peptidase Clp S14 family 0.0056 0.0182 0.0189
Loa Loa (eye worm) hypothetical protein 0.0261 0.3159 0.3647
Trypanosoma cruzi PAB1-binding protein , putative 0.0073 0.0431 0.4203
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0086 0.0615 0.6007
Schistosoma mansoni alpha-glucosidase 0.0139 0.1392 0.1446
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0048 0.0065 0.0637
Echinococcus multilocularis importin subunit beta 1 0.006 0.023 0.0239
Loa Loa (eye worm) TAR-binding protein 0.0124 0.116 0.1339
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Mycobacterium ulcerans beta-lactamase 0.0114 0.1024 1
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Schistosoma mansoni survival motor neuron protein 0.0053 0.0134 0.0139
Echinococcus multilocularis peptidase Clp (S14 family) 0.0056 0.0182 0.0189
Onchocerca volvulus 0.0053 0.0134 0.0655
Trypanosoma cruzi PAB1-binding protein , putative 0.0073 0.0431 0.4203
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0044 0 0.5
Schistosoma mansoni hypothetical protein 0.005 0.0087 0.009
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0086 0.0615 0.6007
Echinococcus granulosus tar DNA binding protein 0.0124 0.116 0.1205
Brugia malayi hypothetical protein 0.0073 0.0431 0.1363
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0086 0.0615 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0158 0.166 0.1917
Mycobacterium ulcerans hypothetical protein 0.0114 0.1024 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0114 0.1024 1
Trypanosoma cruzi importin beta-1 subunit, putative 0.0048 0.0065 0.0637
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1024 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0012 0.0012
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Echinococcus granulosus geminin 0.0704 0.9629 1
Toxoplasma gondii HEAT repeat-containing protein 0.006 0.023 0.2246
Loa Loa (eye worm) hypothetical protein 0.0086 0.0615 0.0711
Loa Loa (eye worm) hypothetical protein 0.0108 0.0932 0.1076
Trichomonas vaginalis D-aminoacylase, putative 0.0114 0.1024 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.0012 0.0012
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0263 0.3187 0.3309
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.0012 0.0037
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.116 0.3672
Loa Loa (eye worm) hypothetical protein 0.0158 0.166 0.1917
Plasmodium vivax importin-beta 2, putative 0.006 0.023 0.2246
Plasmodium falciparum importin beta, putative 0.006 0.023 0.3738
Trypanosoma brucei PAB1-binding protein , putative 0.0073 0.0431 0.4203
Echinococcus granulosus GPCR family 2 0.005 0.0087 0.009
Mycobacterium ulcerans lipase LipD 0.0114 0.1024 1
Trypanosoma brucei importin beta-1 subunit, putative 0.006 0.023 0.2246
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0114 0.1024 0.0858
Loa Loa (eye worm) hypothetical protein 0.0114 0.1024 0.1183
Brugia malayi beta-lactamase family protein 0.0114 0.1024 0.3243
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0114 0.1024 0.3243
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0638 0.866 1
Schistosoma mansoni tar DNA-binding protein 0.0124 0.116 0.1205
Echinococcus granulosus survival motor neuron protein 1 0.0261 0.3159 0.328
Trypanosoma brucei importin beta-1 subunit, putative 0.006 0.023 0.2246
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.116 0.1339
Schistosoma mansoni thyroid hormone receptor 0.0284 0.3494 0.3629
Schistosoma mansoni tar DNA-binding protein 0.0124 0.116 0.1205
Leishmania major importin beta-1 subunit, putative 0.0048 0.0065 0.0637
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0086 0.0615 0.0639
Schistosoma mansoni alpha-glucosidase 0.0139 0.1392 0.1446
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.0012 0.0014
Schistosoma mansoni hypothetical protein 0.005 0.0087 0.009
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.0012 0.0012
Onchocerca volvulus 0.0094 0.0725 0.6862
Mycobacterium tuberculosis Probable lipase LipE 0.0114 0.1024 0.0858
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0086 0.0615 0.5
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0114 0.1024 0.1064
Brugia malayi beta-lactamase 0.0114 0.1024 0.3243
Schistosoma mansoni hypothetical protein 0.0638 0.866 0.8993
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.005 0.0087 0.009
Mycobacterium tuberculosis Probable hydrolase 0.0114 0.1024 0.0858
Mycobacterium tuberculosis Probable esterase LipL 0.0114 0.1024 0.0858
Schistosoma mansoni hypothetical protein 0.005 0.0087 0.009
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0263 0.3187 0.3309
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0086 0.0615 1
Brugia malayi hypothetical protein 0.0047 0.0051 0.016
Brugia malayi beta-lactamase family protein 0.0114 0.1024 0.3243
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0158 0.166 0.5255
Echinococcus multilocularis thyroid hormone receptor alpha 0.0284 0.3494 0.3629
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0048 0.0065 0.0637
Brugia malayi Glycosyl hydrolases family 31 protein 0.0162 0.1721 0.545
Echinococcus multilocularis lysosomal alpha glucosidase 0.0162 0.1721 0.1788

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.