Detailed information for compound 1893953

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 419.43 | Formula: C24H32Cl2N2
  • H donors: 0 H acceptors: 0 LogP: 6.8 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)C(N1CCN(CC1)C1CCCCC1)Cc1ccccc1.Cl
  • InChi: 1S/C24H31ClN2.ClH/c25-22-13-11-21(12-14-22)24(19-20-7-3-1-4-8-20)27-17-15-26(16-18-27)23-9-5-2-6-10-23;/h1,3-4,7-8,11-14,23-24H,2,5-6,9-10,15-19H2;1H
  • InChiKey: PVYFJVKUQZULOB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

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 Pleckstrin G protein, interacting region 0.001 0.0104 0.0056
Loa Loa (eye worm) DIX domain-containing protein 0.001 0.0104 0.0105
Onchocerca volvulus 0.0032 0.0537 0.0539
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.0009 0.0095 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0132 0.2515 0.2753
Brugia malayi RasGEF domain containing protein 0.0007 0.0048 0.0044
Entamoeba histolytica glycogen phosphorylase, putative 0.0201 0.389 0.4237
Schistosoma mansoni camp-dependent rap1 guanine-nucleotide exchange factor 0.0007 0.0042 0.0046
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Schistosoma mansoni hypothetical protein 0.0017 0.0254 0.0279
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0009 0.0088 0.0096
Echinococcus multilocularis segment polarity protein dishevelled 0.001 0.0104 0.0056
Schistosoma mansoni hypothetical protein 0.0038 0.0654 0.0717
Schistosoma mansoni apoferritin-2 0.0009 0.0095 0.0104
Echinococcus multilocularis glycogen phosphorylase 0.0465 0.9115 0.9111
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0066 0.0018
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.001 0.0104 0.0105
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0066 0.0018
Schistosoma mansoni ras GTP exchange factor 0.0007 0.0048 0.0053
Echinococcus multilocularis mothers against decapentaplegic 5 0.0009 0.0088 0.0039
Brugia malayi carbohydrate phosphorylase 0.0465 0.9115 1
Schistosoma mansoni smad1 5 8 and 0.0009 0.0088 0.0096
Echinococcus multilocularis neuropeptide receptor A26 0.051 1 1
Echinococcus multilocularis Smad4 0.0009 0.0088 0.0039
Echinococcus granulosus glycogen phosphorylase 0.0465 0.9115 0.9111
Trypanosoma cruzi hypothetical protein 0.0007 0.0048 0.5
Trypanosoma cruzi guanine nucleotide releasing protein, putative 0.0007 0.0048 0.5
Echinococcus granulosus smad 0.0009 0.0088 0.0039
Brugia malayi MH2 domain containing protein 0.0132 0.2515 0.2753
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0055 0.0998 0.1087
Brugia malayi hypothetical protein 0.001 0.0104 0.0105
Mycobacterium ulcerans glycogen phosphorylase GlgP 0.0201 0.389 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0066 0.0072
Brugia malayi Smad1 0.0009 0.0088 0.0087
Trypanosoma cruzi hypothetical protein 0.0007 0.0048 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Schistosoma mansoni smad1 5 8 and 0.0009 0.0088 0.0096
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0052 0.0004
Echinococcus multilocularis glycogen phosphorylase 0.0465 0.9115 0.9111
Entamoeba histolytica glycogenphosphorylase, putative 0.0201 0.389 0.4237
Echinococcus granulosus neuropeptide receptor A26 0.051 1 1
Schistosoma mansoni z-protein (S1r protein) 0.001 0.0104 0.0114
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0066 0.0018
Echinococcus multilocularis neuropeptide s receptor 0.051 1 1
Echinococcus multilocularis regulator of G protein signaling 7 0.001 0.0104 0.0056
Trichomonas vaginalis ferritin, putative 0.0009 0.0095 0.0052
Echinococcus multilocularis GPCR, family 2 0.0017 0.0254 0.0207
Brugia malayi N-terminal motif family protein 0.0199 0.3849 0.4217
Loa Loa (eye worm) latrophilin receptor protein 2 0.0017 0.0254 0.027
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.0537 0.058
Brugia malayi regulator of G-protein signaling egl-10 0.001 0.0104 0.0105
Trichomonas vaginalis glycogen phosphorylase, putative 0.0465 0.9115 1
Schistosoma mansoni hypothetical protein 0.0187 0.3607 0.3957
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Schistosoma mansoni ferritin light chain 0.0009 0.0095 0.0104
Treponema pallidum bacterioferrin (TpF1) 0.0009 0.0095 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004
Toxoplasma gondii histone lysine methyltransferase SET1 0.006 0.1097 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0009 0.0088 0.0087
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0017 0.0254 0.0207
Echinococcus granulosus mothers against decapentaplegic 5 0.0009 0.0088 0.0039
Schistosoma mansoni glycogen phosphorylase 0.0465 0.9115 1
Schistosoma mansoni cpg binding protein 0.0033 0.0572 0.0628
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.001 0.0104 0.0114
Brugia malayi RasGEF domain containing protein 0.0007 0.0048 0.0044
Loa Loa (eye worm) hypothetical protein 0.0007 0.0048 0.0044
Brugia malayi N-terminal motif family protein 0.0007 0.0048 0.0044
Schistosoma mansoni guanine-nucleotide-exchange-factor 0.0007 0.0048 0.0053
Echinococcus granulosus segment polarity protein dishevelled 0.001 0.0104 0.0056
Loa Loa (eye worm) hypothetical protein 0.001 0.0104 0.0105
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0055 0.0998 0.1087
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0102 0.0102
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0017 0.0254 0.0207
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0104 0.0056
Brugia malayi hypothetical protein 0.001 0.0104 0.0105
Echinococcus granulosus expressed protein 0.0009 0.0095 0.0047
Schistosoma mansoni dishevelled 0.001 0.0104 0.0114
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0067 0.1239 0.136
Loa Loa (eye worm) transcription factor SMAD2 0.0132 0.2515 0.2753
Brugia malayi CXXC zinc finger family protein 0.0032 0.0537 0.058
Mycobacterium tuberculosis Probable glycogen phosphorylase GlgP 0.0201 0.389 1
Schistosoma mansoni hypothetical protein 0.0017 0.0254 0.0279
Echinococcus granulosus Smad4 0.0009 0.0088 0.0039
Loa Loa (eye worm) hypothetical protein 0.0199 0.3849 0.4217
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Schistosoma mansoni smad 0.0009 0.0088 0.0096
Schistosoma mansoni ferritin 0.0009 0.0095 0.0104
Echinococcus granulosus regulator of G protein signaling 7 0.001 0.0104 0.0056
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0199 0.3849 0.4192
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.001 0.0104 0.0105
Schistosoma mansoni dishevelled 0.001 0.0104 0.0114
Loa Loa (eye worm) RasGEF domain-containing protein 0.0007 0.0048 0.0044
Schistosoma mansoni glycogen phosphorylase 0.0201 0.389 0.4268
Onchocerca volvulus Glycogen phosphorylase homolog 0.0465 0.9115 1
Echinococcus multilocularis regulator of G protein signaling 7 0.001 0.0104 0.0056
Loa Loa (eye worm) Smad1 0.0009 0.0088 0.0087
Schistosoma mansoni cpg binding protein 0.0032 0.0537 0.0589
Echinococcus granulosus Glycosyl transferase family 35 0.0465 0.9115 0.9111
Schistosoma mansoni apoferritin-2 0.0009 0.0095 0.0104
Loa Loa (eye worm) hypothetical protein 0.0055 0.0998 0.1087
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0104 0.0056
Brugia malayi MH2 domain containing protein 0.0009 0.0088 0.0087
Schistosoma mansoni smad1 5 8 and 0.0009 0.0088 0.0096
Schistosoma mansoni hypothetical protein 0.0017 0.0254 0.0279
Echinococcus multilocularis smad 0.0009 0.0088 0.0039
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004
Schistosoma mansoni cpg binding protein 0.0033 0.0572 0.0628
Loa Loa (eye worm) hypothetical protein 0.001 0.0104 0.0105
Loa Loa (eye worm) hypothetical protein 0.0038 0.0654 0.0709
Echinococcus granulosus regulator of G protein signaling 7 0.001 0.0104 0.0056
Brugia malayi RasGEF domain containing protein 0.0007 0.0048 0.0044
Schistosoma mansoni glycogen phosphorylase 0.0465 0.9115 1
Entamoeba histolytica glycogen phosphorylase, putative 0.0465 0.9115 1
Schistosoma mansoni ferritin 0.0009 0.0095 0.0104
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.001 0.0104 0.0061
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Chlamydia trachomatis glycogen phosphorylase 0.0465 0.9115 0.5
Echinococcus granulosus Pleckstrin G protein interacting region 0.001 0.0104 0.0056
Loa Loa (eye worm) RasGEF domain-containing protein 0.0007 0.0048 0.0044
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0007 0.0048 0.0053
Loa Loa (eye worm) hypothetical protein 0.0017 0.0254 0.027
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0066 0.0018
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0017 0.0254 0.0207
Echinococcus granulosus geminin 0.0187 0.3607 0.3576
Echinococcus granulosus dnaJ subfamily B 0.0451 0.8835 0.8829
Loa Loa (eye worm) MH2 domain-containing protein 0.0009 0.0088 0.0087
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004
Loa Loa (eye worm) glycogen phosphorylase 0.0465 0.9115 1
Brugia malayi Latrophilin receptor protein 2 0.0017 0.0254 0.027
Schistosoma mansoni ferritin 0.0009 0.0095 0.0104
Loa Loa (eye worm) hypothetical protein 0.0007 0.0048 0.0044
Echinococcus multilocularis expressed protein 0.0009 0.0095 0.0047
Giardia lamblia Glycogen phosphorylase 0.0465 0.9115 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Echinococcus multilocularis geminin 0.0187 0.3607 0.3576
Schistosoma mansoni hypothetical protein 0.0187 0.3607 0.3957
Schistosoma mansoni dep domain containing protein 0.001 0.0104 0.0114
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0017 0.0254 0.027
Loa Loa (eye worm) hypothetical protein 0.001 0.0104 0.0105
Onchocerca volvulus 0.001 0.0104 0.0061
Echinococcus granulosus GPCR family 2 0.0017 0.0254 0.0207
Loa Loa (eye worm) RasGEF domain-containing protein 0.0007 0.0048 0.0044
Schistosoma mansoni regulator of G protein signaling 0.001 0.0104 0.0114
Brugia malayi latrophilin 2 splice variant baaae 0.0038 0.0654 0.0709
Brugia malayi Calcitonin receptor-like protein seb-1 0.0055 0.0998 0.1087
Brugia malayi MH2 domain containing protein 0.0009 0.0088 0.0087
Echinococcus multilocularis cpg binding protein 0.0033 0.0572 0.0527
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0007 0.0048 0.0053
Echinococcus multilocularis Glycosyl transferase, family 35 0.0465 0.9115 0.9111
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.001 0.0104 0.0105
Entamoeba histolytica glycogen phosphorylase, putative 0.0201 0.389 0.4237
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0009 0.0095 0.5
Echinococcus granulosus ferritin 0.0009 0.0095 0.0047
Trichomonas vaginalis helicase, putative 0.0007 0.0052 0.0004
Echinococcus granulosus glycogen phosphorylase 0.0465 0.9115 0.9111
Echinococcus multilocularis dnaJ subfamily B 0.0451 0.8835 0.8829
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0007 0.0048 0.0053
Schistosoma mansoni hypothetical protein 0.0017 0.0254 0.0279
Schistosoma mansoni ferritin light chain 0.0009 0.0095 0.0104
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0017 0.0254 0.0207
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Schistosoma mansoni ferritin 0.0009 0.0095 0.0104
Brugia malayi MH1 domain containing protein 0.0009 0.0088 0.0087
Loa Loa (eye worm) histone methyltransferase 0.001 0.0104 0.0105
Echinococcus granulosus segment polarity protein dishevelled 0.001 0.0104 0.0056
Echinococcus granulosus TGF beta signal transducer SmadC 0.0009 0.0088 0.0039
Echinococcus multilocularis ferritin 0.0009 0.0095 0.0047
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0009 0.0088 0.0039
Schistosoma mansoni Smad4 0.0009 0.0088 0.0096
Trichomonas vaginalis glycogen phosphorylase, putative 0.0465 0.9115 1
Brugia malayi N-terminal motif family protein 0.0007 0.0048 0.0044
Brugia malayi MH1 domain containing protein 0.0009 0.0088 0.0087
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0052 0.0004
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004
Echinococcus granulosus cpg binding protein 0.0033 0.0572 0.0527
Schistosoma mansoni hypothetical protein 0.0451 0.8835 0.9692
Echinococcus multilocularis segment polarity protein dishevelled 0.001 0.0104 0.0056
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0052 0.0004
Entamoeba histolytica glycogen phosphorylase, putative 0.0465 0.9115 1
Brugia malayi DIX domain containing protein 0.001 0.0104 0.0105
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0052 0.0004

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.