Detailed information for compound 874984

Basic information

Technical information
  • TDR Targets ID: 874984
  • Name: N-(2-fluorophenyl)-1-(4-fluorophenyl)-3-methy l-5-pyrrol-1-ylpyrazole-4-carboxamide
  • MW: 378.375 | Formula: C21H16F2N4O
  • H donors: 1 H acceptors: 2 LogP: 4.06 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)n1nc(c(c1n1cccc1)C(=O)Nc1ccccc1F)C
  • InChi: 1S/C21H16F2N4O/c1-14-19(20(28)24-18-7-3-2-6-17(18)23)21(26-12-4-5-13-26)27(25-14)16-10-8-15(22)9-11-16/h2-13H,1H3,(H,24,28)
  • InChiKey: QRIAGUUIYFRBOR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-fluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide
  • N-(2-fluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide

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 cyclin dependent kinase 5 0.0044 0.0445 0.095
Echinococcus multilocularis transcription factor collier 0.0033 0.0243 0.0516
Loa Loa (eye worm) CYP4Cod1 0.0029 0.0185 0.0393
Brugia malayi Protein kinase domain containing protein 0.0276 0.4671 1
Onchocerca volvulus 0.0074 0.1003 0.3469
Brugia malayi Furin-like cysteine rich region family protein 0.0133 0.2067 0.4424
Brugia malayi Sema domain containing protein 0.0074 0.1003 0.2144
Echinococcus granulosus c src tyrosine kinase 0.0023 0.0069 0.0067
Schistosoma mansoni hypothetical protein 0.0074 0.1003 0.2147
Echinococcus granulosus tyrosine protein kinase Lyn 0.0024 0.0085 0.0084
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Loa Loa (eye worm) sema domain-containing protein 0.0074 0.1003 0.2144
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0445 1
Schistosoma mansoni tyrosine kinase 0.0276 0.4671 1
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0044 0.0445 0.095
Giardia lamblia Kinase, CMGC CDK 0.0044 0.0445 0.5
Echinococcus multilocularis Immunoglobulin 0.004 0.0385 0.0821
Onchocerca volvulus 0.0138 0.2167 0.7503
Plasmodium falciparum protein kinase 5 0.0044 0.0445 0.5
Schistosoma mansoni tyrosine kinase 0.0133 0.2067 0.4426
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Entamoeba histolytica cell division protein kinase 2, putative 0.0044 0.0445 0.8463
Trypanosoma brucei cdc2-related kinase 3 0.0044 0.0445 1
Onchocerca volvulus Tyrosine kinase homolog 0.0156 0.2493 0.8634
Echinococcus multilocularis exocyst complex component 2 0.0033 0.0243 0.0516
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.0185 0.0393
Schistosoma mansoni vesicular amine transporter 0.004 0.0385 0.0825
Schistosoma mansoni tyrosine kinase 0.0023 0.0069 0.0147
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0023 0.0069 0.0143
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0445 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.0023 0.0069 0.0067
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Loa Loa (eye worm) plexin A 0.021 0.348 0.745
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Brugia malayi hypothetical protein 0.0074 0.1003 0.2144
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Schistosoma mansoni tyrosine kinase 0.0021 0.0032 0.0068
Loa Loa (eye worm) hypothetical protein 0.0043 0.0441 0.094
Echinococcus multilocularis c src tyrosine kinase 0.0023 0.0069 0.0143
Schistosoma mansoni plexin 0.0178 0.2887 0.6182
Echinococcus granulosus tyrosine protein kinase Fyn 0.0023 0.0069 0.0067
Echinococcus multilocularis plexin a4 0.021 0.348 0.745
Echinococcus granulosus epidermal growth factor receptor 0.0133 0.2067 0.2066
Schistosoma mansoni tyrosine kinase 0.0117 0.1784 0.382
Echinococcus multilocularis epidermal growth factor receptor 0.0133 0.2067 0.4424
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0044 0.0445 1
Schistosoma mansoni tyrosine kinase 0.0023 0.0069 0.0147
Plasmodium vivax protein kinase Crk2 0.0044 0.0445 0.5
Schistosoma mansoni tyrosine kinase 0.0133 0.2067 0.4426
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0197 0.324 0.6937
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Loa Loa (eye worm) hypothetical protein 0.0178 0.2887 0.6181
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0023 0.0069 0.0143
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0023 0.0069 0.0143
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0044 0.0445 0.095
Echinococcus multilocularis insulin receptor 0.0276 0.4671 1
Brugia malayi DNA-binding protein LAG-1 0.0033 0.0243 0.0516
Schistosoma mansoni tyrosine kinase 0.0023 0.0069 0.0147
Schistosoma mansoni tyrosine kinase 0.0133 0.2067 0.4426
Brugia malayi Cytochrome P450 family protein 0.0031 0.0207 0.0439
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0043 0.0441 0.0439
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0023 0.0069 0.0143
Echinococcus multilocularis tyrosine protein kinase Abl 0.0023 0.0069 0.0143
Loa Loa (eye worm) cytochrome P450 family protein 0.0031 0.0207 0.0439
Brugia malayi Protein kinase domain containing protein 0.0044 0.0445 0.095
Brugia malayi Cytochrome P450 family protein 0.0029 0.0185 0.0393
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0023 0.0069 0.0143
Echinococcus granulosus twitchin 0.0044 0.0445 0.0444
Echinococcus granulosus exocyst complex component 2 0.0033 0.0243 0.0241
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0023 0.0069 0.0067
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0044 0.0445 0.5
Schistosoma mansoni hypothetical protein 0.0104 0.1535 0.3286
Schistosoma mansoni tyrosine kinase 0.0117 0.1784 0.382
Loa Loa (eye worm) TK/INSR protein kinase 0.0276 0.4671 1
Echinococcus multilocularis roundabout 2 0.0046 0.0484 0.1033
Trypanosoma cruzi cdc2-related kinase 3 0.0044 0.0445 1
Schistosoma mansoni serine/threonine protein kinase 0.0044 0.0445 0.0953
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0276 0.4671 0.467
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0023 0.0069 0.0147
Echinococcus granulosus semaphorin 5B 0.0074 0.1003 0.1001
Entamoeba histolytica hypothetical protein 0.0033 0.0243 0.4598
Schistosoma mansoni nephrin 0.0043 0.0429 0.0918
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0276 0.4671 1
Entamoeba histolytica tyrosin kinase, putative 0.0048 0.0526 1
Echinococcus granulosus insulin receptor 0.0276 0.4671 0.467
Echinococcus multilocularis neuroglian 0.0043 0.0429 0.0914
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0023 0.0069 0.0067
Entamoeba histolytica hypothetical protein 0.0033 0.0243 0.4598
Loa Loa (eye worm) hypothetical protein 0.0046 0.0484 0.1033
Trypanosoma cruzi cdc2-related kinase 3 0.0044 0.0445 1
Echinococcus multilocularis Immunoglobulin 0.004 0.0385 0.0821
Echinococcus multilocularis 0.0034 0.0274 0.0583
Brugia malayi Immunoglobulin I-set domain containing protein 0.0197 0.324 0.6937
Schistosoma mansoni serine/threonine protein kinase 0.0181 0.2942 0.63
Loa Loa (eye worm) TK/EGFR protein kinase 0.0133 0.2067 0.4424
Schistosoma mansoni semaphorin 5-related 0.0074 0.1003 0.2147
Loa Loa (eye worm) hypothetical protein 0.0104 0.1535 0.3283
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0044 0.0445 0.095
Echinococcus granulosus MAP kinase activated protein kinase 2 0.0181 0.2942 0.2941
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Schistosoma mansoni fibrocystin l 0.0033 0.0243 0.052
Echinococcus multilocularis hypothetical protein 0.0074 0.1003 0.2144
Entamoeba histolytica cell surface protease gp63, putative 0.0033 0.0243 0.4598
Loa Loa (eye worm) hypothetical protein 0.0033 0.0243 0.0516
Brugia malayi Plexin repeat family protein 0.0178 0.2887 0.6181
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0044 0.0445 0.0444
Trypanosoma cruzi cdc2-related kinase 1 0.0044 0.0445 1
Brugia malayi cell division control protein 2 homolog 0.0044 0.0445 0.095
Entamoeba histolytica hypothetical protein 0.0033 0.0243 0.4598
Echinococcus granulosus epidermal growth factor receptor 0.0133 0.2067 0.2066
Trypanosoma brucei cdc2-related kinase 1 0.0044 0.0445 1
Trypanosoma cruzi cdc2-related kinase 1 0.0044 0.0445 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Brugia malayi Tyrosine-protein kinase abl-1 0.0023 0.0069 0.0143
Loa Loa (eye worm) camk/mapkapk/mapkapk protein kinase 0.0181 0.2942 0.6298
Loa Loa (eye worm) hypothetical protein 0.0043 0.0428 0.0914
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0445 1
Schistosoma mansoni serine/threonine protein kinase 0.0044 0.0445 0.0953
Brugia malayi Immunoglobulin I-set domain containing protein 0.004 0.0385 0.0821
Schistosoma mansoni cell adhesion molecule 0.0043 0.0441 0.0943
Entamoeba histolytica hypothetical protein 0.0033 0.0243 0.4598
Echinococcus granulosus neuroglian 0.0043 0.0429 0.0427
Schistosoma mansoni hypothetical protein 0.0033 0.0243 0.052
Schistosoma mansoni tyrosine kinase 0.0019 0.0002 0.0004
Echinococcus granulosus transcription factor collier 0.0033 0.0243 0.0241
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0023 0.0069 0.0143
Echinococcus granulosus cyclin dependent kinase 5 0.0044 0.0445 0.0444
Brugia malayi Fibronectin type III domain containing protein 0.004 0.0385 0.0821
Brugia malayi plexin A 0.021 0.348 0.745
Echinococcus granulosus tyrosine protein kinase Fyn 0.0023 0.0069 0.0067
Schistosoma mansoni hypothetical protein 0.0074 0.1003 0.2147
Echinococcus multilocularis cyclin dependent kinase 1 0.0044 0.0445 0.095
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0133 0.2067 0.2066
Giardia lamblia Kinase, CMGC CDK 0.0044 0.0445 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.0185 0.0393
Schistosoma mansoni Neurotrimin precursor (hNT) 0.004 0.0385 0.0825
Brugia malayi hypothetical protein 0.004 0.0385 0.0821
Loa Loa (eye worm) hypothetical protein 0.0033 0.0243 0.0516
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0044 0.0445 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.1003 0.2144
Echinococcus granulosus Immunoglobulin 0.004 0.0385 0.0384
Brugia malayi Cytochrome P450 family protein 0.0029 0.0185 0.0393
Brugia malayi SRC-1 0.0023 0.0069 0.0143
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Loa Loa (eye worm) hypothetical protein 0.0046 0.0484 0.1033
Schistosoma mansoni tyrosine kinase 0.0117 0.1784 0.382
Echinococcus multilocularis cyclin dependent kinase 1 0.0044 0.0445 0.095
Echinococcus granulosus tyrosine protein kinase Src64B 0.0023 0.0069 0.0067
Loa Loa (eye worm) hypothetical protein 0.004 0.0385 0.0821
Schistosoma mansoni plexin 0.0104 0.1535 0.3286
Onchocerca volvulus 0.0178 0.2887 1
Schistosoma mansoni tyrosine kinase 0.0019 0.0002 0.0004
Echinococcus granulosus cyclin dependent kinase 0.0044 0.0445 0.0444
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0023 0.0069 0.0143
Echinococcus granulosus plexin a4 0.021 0.348 0.3479
Echinococcus multilocularis cyclin dependent kinase 0.0044 0.0445 0.095
Echinococcus granulosus tyrosine protein kinase Fyn 0.0023 0.0069 0.0067
Loa Loa (eye worm) hypothetical protein 0.0033 0.0243 0.0516
Echinococcus granulosus cyclin dependent kinase 1 0.0044 0.0445 0.0444
Echinococcus multilocularis MAP kinase activated protein kinase 2 0.0181 0.2942 0.6298
Loa Loa (eye worm) sema domain-containing protein 0.0074 0.1003 0.2144
Loa Loa (eye worm) hypothetical protein 0.0033 0.0243 0.0516
Schistosoma mansoni tyrosine kinase 0.0276 0.4671 1
Brugia malayi IPT/TIG domain containing protein 0.0033 0.0243 0.0516
Echinococcus multilocularis epidermal growth factor receptor 0.0133 0.2067 0.4424
Entamoeba histolytica protein kinase domain containing protein 0.0048 0.0526 1
Echinococcus granulosus defective proboscis extension response 0.004 0.0385 0.0384
Brugia malayi Probable exocyst complex component Sec5 0.0033 0.0243 0.0516
Brugia malayi map kinase activated protein kinase protein 2 0.0181 0.2942 0.6298
Schistosoma mansoni tyrosine kinase 0.0023 0.0069 0.0147
Loa Loa (eye worm) hypothetical protein 0.0143 0.2254 0.4823
Brugia malayi Sema domain containing protein 0.0074 0.1003 0.2144
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0023 0.0069 0.0143
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0029 0.0185 0.5
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0023 0.0069 0.0143
Brugia malayi hypothetical protein 0.0074 0.1003 0.2144
Echinococcus granulosus roundabout 2 0.0046 0.0484 0.0482
Echinococcus multilocularis basement membrane specific heparan sulfate 0.004 0.0385 0.0821
Loa Loa (eye worm) SRC-1 0.0023 0.0069 0.0143
Echinococcus granulosus semaphorin 1A 0.0074 0.1003 0.1001
Brugia malayi Protein kinase domain containing protein 0.0159 0.2537 0.5429
Entamoeba histolytica cell division protein kinase 2, putative 0.0044 0.0445 0.8463
Schistosoma mansoni hypothetical protein 0.0033 0.0243 0.052
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.004 0.0385 0.0825
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0023 0.0069 0.0143
Echinococcus multilocularis semaphorin 5B 0.0074 0.1003 0.2144
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0023 0.0069 0.0067

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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