Detailed information for compound 1773314

Basic information

Technical information
  • TDR Targets ID: 1773314
  • Name: N-[5-(3-chlorophenyl)-[1,2,4]triazolo[1,5-a]p yridin-2-yl]cyclopropanecarboxamide
  • MW: 312.754 | Formula: C16H13ClN4O
  • H donors: 1 H acceptors: 3 LogP: 3 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1CC1)Nc1nn2c(n1)cccc2c1cccc(c1)Cl
  • InChi: 1S/C16H13ClN4O/c17-12-4-1-3-11(9-12)13-5-2-6-14-18-16(20-21(13)14)19-15(22)10-7-8-10/h1-6,9-10H,7-8H2,(H,19,20,22)
  • InChiKey: PHBDHHUATHARRH-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens Janus kinase 1 Starlite/ChEMBL References
Homo sapiens Janus kinase 2 Starlite/ChEMBL References

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) SRC-1 0.001 0.0168 0.0168
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0066 0.4394 0.4298
Echinococcus multilocularis voltage gated potassium channel 0.0012 0.0284 0.0284
Brugia malayi SH2 domain containing protein 0.001 0.0168 0.0168
Schistosoma mansoni retinoic acid receptor RXR 0.014 1 1
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Brugia malayi nuclear receptor RXR 0.0074 0.4994 0.4994
Onchocerca volvulus 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.4994 0.4994
Schistosoma mansoni nuclear hormone receptor 0.0066 0.4394 0.4394
Brugia malayi orphan nuclear receptor NR2E1 0.0066 0.4394 0.4394
Brugia malayi hypothetical protein 0.0074 0.4994 0.4994
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase Blk 0.001 0.0168 0.0168
Brugia malayi hypothetical protein 0.0066 0.4394 0.4394
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.014 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.014 1 1
Brugia malayi nuclear hormone receptor 0.0066 0.4394 0.4394
Onchocerca volvulus Bile acid receptor homolog 0.014 1 1
Onchocerca volvulus 0.0066 0.4394 0.4298
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.014 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.014 1 1
Brugia malayi Protein kinase domain containing protein 0.001 0.0168 0.0168
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase Src42A 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase ABL1 0.001 0.0168 0.0168
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.014 1 1
Loa Loa (eye worm) TK protein kinase 0.001 0.0168 0.0168
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.001 0.0168 0.0168
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0066 0.4394 0.4394
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.014 1 1
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0066 0.4394 0.4394
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Brugia malayi nuclear receptor NHR-88 0.0066 0.4394 0.4394
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor-like 1 0.0074 0.4994 0.4994
Brugia malayi nuclear receptor NHR-88 0.014 1 1
Schistosoma mansoni RAR-like nuclear receptor 0.014 1 1
Brugia malayi hypothetical protein 0.0074 0.4994 0.4994
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Echinococcus granulosus nuclear receptor nhr 48 0.0066 0.4394 0.4394
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Brugia malayi Tyrosine-protein kinase abl-1 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0012 0.0284 0.0284
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Brugia malayi Protein kinase domain containing protein 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0012 0.0284 0.0284
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Echinococcus multilocularis FTZ F1 alpha 0.014 1 1
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0066 0.4394 0.4394
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.014 1 1
Schistosoma mansoni nuclear receptor 0.0066 0.4394 0.4394
Schistosoma mansoni Tr4/Tr2 (homologue) 0.014 1 1
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Brugia malayi nuclear hormone receptor family member nhr-6 0.0066 0.4394 0.4394
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0066 0.4394 0.4394
Echinococcus multilocularis tyrosine protein kinase Srms 0.001 0.0168 0.0168
Schistosoma mansoni zinc finger protein 0.0066 0.4394 0.4394
Echinococcus granulosus tyrosine kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor family member nhr-25 0.014 1 1
Echinococcus granulosus FTZ F1 alpha 0.014 1 1
Echinococcus granulosus thyroid hormone receptor alpha 0.0066 0.4394 0.4394
Schistosoma mansoni coup transcription factor 0.014 1 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.014 1 1
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Brugia malayi nuclear receptor RXR 0.0066 0.4394 0.4394
Echinococcus granulosus tyrosine protein kinase Fps85D 0.001 0.0168 0.0168
Schistosoma mansoni voltage-gated potassium channel 0.0045 0.2764 0.2764
Brugia malayi Nuclear hormone receptor family member nhr-25 0.014 1 1
Echinococcus granulosus tyrosine protein kinase Srms 0.001 0.0168 0.0168
Echinococcus granulosus tyrosine protein kinase Src42A 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.001 0.0168 0.0168
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0038 0.2277 1
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor family member nhr-3 0.014 1 1
Echinococcus granulosus tyrosine protein kinase Src64B 0.001 0.0168 0.0168
Echinococcus granulosus nuclear receptor 2DBD gamma 0.014 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.014 1 1
Brugia malayi SH2 domain containing protein 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0035 0.2072 0.2072
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.014 1 1
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0074 0.4994 0.4994
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0041 0.248 0.248
Brugia malayi Protein kinase domain containing protein 0.001 0.0168 0.0168
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.014 1 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0066 0.4394 0.4394
Echinococcus granulosus tyrosine protein kinase Lyn 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Brugia malayi Nuclear hormone receptor family member nhr-14 0.014 1 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.014 1 1
Brugia malayi hypothetical protein 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Echinococcus multilocularis thyroid hormone receptor alpha 0.014 1 1
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) DR-78 0.0066 0.4394 0.4394
Schistosoma mansoni voltage-gated potassium channel 0.0045 0.2764 0.2764
Brugia malayi nuclear hormone receptor family member odr-7 0.0066 0.4394 0.4394
Loa Loa (eye worm) TK/ABL protein kinase 0.001 0.0168 0.0168
Echinococcus granulosus tyrosine protein kinase Blk 0.001 0.0168 0.0168
Echinococcus granulosus voltage gated potassium channel 0.0012 0.0284 0.0284
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.001 0.0168 0.0168
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0012 0.0284 0.0284
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.014 1 1
Brugia malayi SRC-1 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.001 0.0168 0.0168
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0012 0.0284 0.0284
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0074 0.4994 0.4994
Brugia malayi Nuclear hormone receptor-like 1 0.0074 0.4994 0.4994
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Brugia malayi tailless protein 0.0066 0.4394 0.4394
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.014 1 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Loa Loa (eye worm) steroid hormone receptor 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.4994 0.4994
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0074 0.4994 0.4994
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.014 1 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.014 1 1
Echinococcus granulosus tyrosine protein kinase ABL1 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor family member nhr-40 0.014 1 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0041 0.248 0.248
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0038 0.2277 1
Echinococcus granulosus tyrosine protein kinase shark 0.001 0.0168 0.0168
Schistosoma mansoni thyroid hormone receptor 0.014 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.014 1 1
Schistosoma mansoni tyrosine kinase 0.001 0.0168 0.0168
Echinococcus granulosus Nuclear hormone receptor HR96 0.0066 0.4394 0.4394
Loa Loa (eye worm) nuclear receptor NHR-67 0.0066 0.4394 0.4394
Echinococcus granulosus retinoic acid receptor rxr beta a 0.014 1 1
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.001 0.0168 0.0168
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.014 1 1
Entamoeba histolytica SH2-protein kinase domain containing protein 0.001 0.0168 0.5
Onchocerca volvulus Protein ultraspiracle homolog 0.014 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0012 0.0284 0.0284
Brugia malayi nuclear hormone receptor 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.4994 0.4994
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0066 0.4394 0.4394
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0066 0.4394 0.4394
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0066 0.4394 0.4394
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0074 0.4994 0.4994
Echinococcus granulosus tyrosine protein kinase Btk29A 0.001 0.0168 0.0168
Echinococcus granulosus ecdysone induced protein 78C 0.014 1 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.014 1 1
Schistosoma mansoni nuclear hormone receptor 0.0066 0.4394 0.4394
Brugia malayi Nuclear hormone receptor family member nhr-19 0.014 1 1
Brugia malayi Nuclear hormone receptor E75 0.0066 0.4394 0.4394
Brugia malayi protein-tyrosine kinase 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor family member nhr-41 0.014 1 1
Echinococcus multilocularis tyrosine protein kinase Abl 0.001 0.0168 0.0168
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.014 1 1
Schistosoma mansoni nuclear receptor nhr-48 0.0066 0.4394 0.4394
Onchocerca volvulus 0.0066 0.4394 0.4298
Echinococcus multilocularis c src tyrosine kinase 0.001 0.0168 0.0168
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0041 0.248 0.248
Brugia malayi steroid hormone receptor 0.014 1 1
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0066 0.4394 0.4298
Brugia malayi Steroid receptor seven-up type 2 0.014 1 1
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.001 0.0168 0.0168
Echinococcus granulosus c src tyrosine kinase 0.001 0.0168 0.0168
Brugia malayi ecdysone receptor 0.0066 0.4394 0.4394
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.014 1 1
Echinococcus granulosus tyrosine kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0066 0.4394 0.4394
Schistosoma mansoni voltage-gated potassium channel 0.0012 0.0284 0.0284
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0066 0.4394 0.4394
Echinococcus multilocularis nuclear receptor nhr 48 0.0066 0.4394 0.4394
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.014 1 1
Brugia malayi Nuclear hormone receptor E75 0.0066 0.4394 0.4394
Loa Loa (eye worm) nuclear hormone receptor 0.0066 0.4394 0.4394
Brugia malayi conserved hypotetical protein 0.0066 0.4394 0.4394
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Loa Loa (eye worm) TK/FER protein kinase 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Brugia malayi hypothetical protein 0.0066 0.4394 0.4394
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.014 1 1
Echinococcus multilocularis tyrosine kinase 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase shark 0.001 0.0168 0.0168
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0074 0.4994 0.4994
Brugia malayi Protein kinase domain containing protein 0.001 0.0168 0.0168
Brugia malayi Nuclear hormone receptor family member nhr-19 0.014 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0074 0.4994 0.4994
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.001 0.0168 0.0168
Brugia malayi nuclear receptor NHR-67 0.0066 0.4394 0.4394
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Schistosoma mansoni retinoid-x-receptor (RXR) 0.014 1 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0041 0.248 0.248
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.014 1 1
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.001 0.0168 0.0168
Schistosoma mansoni nuclear hormone receptor 0.014 1 1
Schistosoma mansoni nuclear receptor 0.0066 0.4394 0.4394
Brugia malayi Protein kinase domain containing protein 0.001 0.0168 0.0168
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0066 0.4394 0.4394
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Schistosoma mansoni thyroid hormone receptor 0.014 1 1
Echinococcus multilocularis ecdysone induced protein 78C 0.014 1 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.014 1 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.014 1 1
Echinococcus multilocularis tyrosine protein kinase Src64B 0.001 0.0168 0.0168
Echinococcus multilocularis tyrosine protein kinase Fgr 0.001 0.0168 0.0168
Loa Loa (eye worm) hypothetical protein 0.0074 0.4994 0.4994
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0066 0.4394 0.4394
Loa Loa (eye worm) hypothetical protein 0.014 1 1
Loa Loa (eye worm) hypothetical protein 0.0066 0.4394 0.4394
Brugia malayi photoreceptor-specific nuclear receptor 0.014 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.014 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 142 nM Inhibition of human recombinant JAK1 ChEMBL. 25369270
Ki (binding) = 0.0597 uM Inhibition of JAK2 (unknown origin) ChEMBL. 23870430

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

2 literature references were collected for this gene.

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