Detailed information for compound 681824

Basic information

Technical information
  • TDR Targets ID: 681824
  • Name: (2-chlorophenyl)-[4-[6-(phenylamino)pyridazin -3-yl]piperazin-1-yl]methanone
  • MW: 393.869 | Formula: C21H20ClN5O
  • H donors: 1 H acceptors: 3 LogP: 3.73 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccccc1C(=O)N1CCN(CC1)c1ccc(nn1)Nc1ccccc1
  • InChi: 1S/C21H20ClN5O/c22-18-9-5-4-8-17(18)21(28)27-14-12-26(13-15-27)20-11-10-19(24-25-20)23-16-6-2-1-3-7-16/h1-11H,12-15H2,(H,23,24)
  • InChiKey: YTXBWBPJMAFTLB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2-chlorophenyl)-[4-[6-(phenylamino)-3-pyridazinyl]-1-piperazinyl]methanone
  • ZINC04304127

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
Brugia malayi jmjC domain containing protein 0.0092 0.9278 0.9278
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.003 0.178 0.1134
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0771 0.5
Echinococcus granulosus lysine specific demethylase 5A 0.0034 0.227 0.1684
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0096 0.9673 1
Echinococcus multilocularis GPCR, family 2 0.003 0.178 0.1134
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.1556 0.0882
Brugia malayi jmjC domain containing protein 0.0034 0.227 0.227
Schistosoma mansoni tar DNA-binding protein 0.0073 0.6949 0.6939
Schistosoma mansoni tar DNA-binding protein 0.0073 0.6949 0.6939
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0096 0.9673 0.9646
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0096 0.9673 1
Schistosoma mansoni tar DNA-binding protein 0.0073 0.6949 0.6939
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.1556 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.003 0.178 0.1094
Echinococcus multilocularis lysine specific demethylase 5A 0.0034 0.227 0.1684
Schistosoma mansoni hypothetical protein 0.0028 0.1556 0.0882
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0096 0.9673 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.1556 0.0851
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0771 0.0771
Brugia malayi Latrophilin receptor protein 2 0.003 0.178 0.178
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0095 0.9596 0.9563
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0022 0.0771 0.5
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.003 0.178 0.178
Schistosoma mansoni jumonji domain containing protein 0.0073 0.6993 0.6989
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.1009 0.3037
Loa Loa (eye worm) TAR-binding protein 0.0073 0.6949 0.6694
Schistosoma mansoni tar DNA-binding protein 0.0073 0.6949 0.6939
Plasmodium falciparum phd finger protein, putative 0.0028 0.1556 1
Schistosoma mansoni hypothetical protein 0.0065 0.5978 0.585
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.1009 0.3037
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.1009 1
Echinococcus granulosus GPCR family 2 0.003 0.178 0.1134
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0095 0.9596 0.9596
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.1556 0.0851
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.1009 0.3037
Leishmania major hypothetical protein, conserved 0.0024 0.1009 1
Echinococcus multilocularis peregrin 0.0028 0.1556 0.0882
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.003 0.178 0.1134
Loa Loa (eye worm) transcription factor SMAD2 0.0098 1 1
Schistosoma mansoni hypothetical protein 0.003 0.178 0.1134
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.9673 1
Echinococcus granulosus peregrin 0.0028 0.1556 0.0882
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.1009 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.1009 0.0258
Echinococcus granulosus jumonji domain containing protein 0.0039 0.2885 0.2375
Schistosoma mansoni hypothetical protein 0.003 0.178 0.1134
Echinococcus granulosus tar DNA binding protein 0.0073 0.6949 0.6939
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.1556 0.0882
Schistosoma mansoni hypothetical protein 0.003 0.178 0.1134
Brugia malayi latrophilin 2 splice variant baaae 0.0065 0.5978 0.5978
Loa Loa (eye worm) jmjC domain-containing protein 0.0058 0.517 0.4767
Brugia malayi Calcitonin receptor-like protein seb-1 0.0095 0.9596 0.9596
Loa Loa (eye worm) RNA binding protein 0.0073 0.6949 0.6694
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.1556 0.0882
Loa Loa (eye worm) jmjC domain-containing protein 0.0034 0.227 0.1625
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0022 0.0771 0.5
Treponema pallidum exodeoxyribonuclease (exoA) 0.0022 0.0771 0.5
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0022 0.0771 0.5
Loa Loa (eye worm) hypothetical protein 0.0065 0.5978 0.5643
Loa Loa (eye worm) hypothetical protein 0.003 0.178 0.1094
Brugia malayi TAR-binding protein 0.0073 0.6949 0.6949
Giardia lamblia PHD finger protein 15 0.0028 0.1556 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0098 1 1
Loa Loa (eye worm) hypothetical protein 0.0095 0.9596 0.9563
Echinococcus multilocularis jumonji domain containing protein 0.0039 0.2885 0.2375
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.1556 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0096 0.9673 0.9673
Brugia malayi RNA recognition motif domain containing protein 0.0073 0.6949 0.6949
Schistosoma mansoni tar DNA-binding protein 0.0073 0.6949 0.6939
Brugia malayi Bromodomain containing protein 0.0028 0.1556 0.1556
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.9673 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.3981 0.3478
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0092 0.9278 0.9556
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.227 0.1684
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.003 0.178 0.1134
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.003 0.178 0.1134
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.1009 0.3037
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0092 0.9278 0.9556
Echinococcus multilocularis tar DNA binding protein 0.0073 0.6949 0.6939
Schistosoma mansoni hypothetical protein 0.003 0.178 0.1134
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0022 0.0771 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0096 0.9673 1
Brugia malayi hypothetical protein 0.0024 0.1009 0.1009
Brugia malayi RNA binding protein 0.0073 0.6949 0.6949
Onchocerca volvulus Alhambra homolog 0.0028 0.1556 0.5
Brugia malayi PHD-finger family protein 0.0028 0.1556 0.1556
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.1009 1
Plasmodium vivax hypothetical protein, conserved 0.0028 0.1556 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.227 0.1684
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0771 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0096 0.9673 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0073 0.6949 0.6694

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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