Detailed information for compound 760301

Basic information

Technical information
  • TDR Targets ID: 760301
  • Name: methyl 3-(3-methylpyrazol-1-yl)propanoate
  • MW: 168.193 | Formula: C8H12N2O2
  • H donors: 0 H acceptors: 2 LogP: 0.39 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)CCn1ccc(n1)C
  • InChi: 1S/C8H12N2O2/c1-7-3-5-10(9-7)6-4-8(11)12-2/h3,5H,4,6H2,1-2H3
  • InChiKey: LMOGXBOZXLEWPG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(3-methyl-1-pyrazolyl)propanoic acid methyl ester
  • 3-(3-methylpyrazol-1-yl)propionic acid methyl ester
  • BAS 03066087
  • 3-(3-Methyl-pyrazol-1-yl)-propionic acid methyl ester
  • SBB009398
  • EU-0083720
  • ZINC00283462

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 musashi 0.0031 0.021 0.1013
Giardia lamblia Nitroreductase family protein fused to ferredoxin domain Fd-NR1 0.0062 0.066 1
Mycobacterium leprae Probable F420 biosynthesis protein FbiB 0.0062 0.066 1
Brugia malayi Thioredoxin reductase 0.0072 0.0814 0.2366
Treponema pallidum NADH oxidase 0.0025 0.0124 0.5
Mycobacterium tuberculosis Probable lipase LipD 0.0041 0.0361 0.068
Echinococcus granulosus thioredoxin glutathione reductase 0.0072 0.0814 0.8147
Schistosoma mansoni lamin 0.0031 0.021 0.0259
Echinococcus multilocularis GA binding protein alpha chain 0.0083 0.097 1
Trypanosoma brucei trypanothione reductase 0.0072 0.0814 0.0698
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0041 0.0361 0.3642
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0018 0.0027 0.0078
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0018 0.0027 0.0078
Giardia lamblia Nitroreductase Fd-NR2 0.0062 0.066 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0072 0.0814 0.1979
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0041 0.0361 0.068
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0361 0.4419
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.0361 0.1049
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.018 0.0815
Trypanosoma cruzi nitroreductase 0.0703 1 1
Echinococcus granulosus GA binding protein alpha chain 0.0083 0.097 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0264 0.3609 1
Loa Loa (eye worm) hypothetical protein 0.0062 0.066 0.192
Echinococcus multilocularis thioredoxin glutathione reductase 0.0072 0.0814 0.8147
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0361 0.4419
Echinococcus multilocularis lamin 0.0031 0.021 0.1013
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0083 0.097 0.2822
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.0361 0.1049
Mycobacterium tuberculosis Putative oxidoreductase 0.0062 0.066 0.1539
Mycobacterium tuberculosis Probable hydrolase 0.0041 0.0361 0.068
Schistosoma mansoni ets-related 0.0253 0.3438 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0775 1
Onchocerca volvulus Iodotyrosine dehalogenase 1 homolog 0.0062 0.066 1
Onchocerca volvulus 0.0041 0.0361 0.3357
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0775 1
Onchocerca volvulus 0.0041 0.0361 0.3357
Plasmodium falciparum glutathione reductase 0.0072 0.0814 1
Trypanosoma brucei nitroreductase 0.0703 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0025 0.0124 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Mycobacterium tuberculosis Probable esterase LipL 0.0041 0.0361 0.068
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.007 0.0775 0.7687
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.0775 0.1963
Mycobacterium leprae conserved hypothetical protein 0.0041 0.0361 0.4419
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Leishmania major hypothetical protein, conserved 0.0041 0.0361 0.024
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Brugia malayi nitroreductase family protein 0.0062 0.066 0.192
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Brugia malayi intermediate filament protein 0.0031 0.021 0.061
Mycobacterium tuberculosis Possible oxidoreductase 0.0062 0.066 0.1539
Mycobacterium tuberculosis Conserved protein Acg 0.0062 0.066 0.1539
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0025 0.0124 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.0361 0.4419
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.007 0.0775 0.1867
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0361 0.3436
Mycobacterium tuberculosis Probable lipase LipE 0.0041 0.0361 0.068
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0025 0.0124 0.5
Schistosoma mansoni lamin 0.0031 0.021 0.0259
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0041 0.0361 0.068
Loa Loa (eye worm) intermediate filament protein 0.0031 0.021 0.061
Loa Loa (eye worm) fli-1 protein 0.0253 0.3438 1
Mycobacterium ulcerans nitroreductase 0.0062 0.066 0.8242
Giardia lamblia Nitroreductase family protein 0.0062 0.066 1
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0041 0.0361 0.068
Mycobacterium tuberculosis Conserved protein 0.0062 0.066 0.1539
Plasmodium vivax glutathione reductase, putative 0.0072 0.0814 1
Mycobacterium tuberculosis Probable F420 biosynthesis protein FbiB 0.0062 0.066 0.1539
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Loa Loa (eye worm) glutathione reductase 0.0072 0.0814 0.2366
Brugia malayi hypothetical protein 0.0029 0.018 0.0524
Entamoeba histolytica nitroreductase family protein 0.0062 0.066 0.5
Mycobacterium ulcerans nitroreductase 0.0062 0.066 0.8242
Mycobacterium leprae Possible oxidoreductase 0.0062 0.066 1
Toxoplasma gondii aldehyde dehydrogenase 0.007 0.0775 0.9435
Toxoplasma gondii thioredoxin reductase 0.0072 0.0814 1
Echinococcus granulosus intermediate filament protein 0.0031 0.021 0.1013
Loa Loa (eye worm) thioredoxin reductase 0.0072 0.0814 0.2366
Mycobacterium ulcerans F420-0--gamma-glutamyl ligase 0.0062 0.066 0.8242
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Trypanosoma cruzi nitroreductase 0.0703 1 1
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0025 0.0124 0.036
Echinococcus granulosus lamin 0.0031 0.021 0.1013
Mycobacterium ulcerans hypothetical protein 0.0062 0.066 0.8242
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.0361 0.2799
Mycobacterium ulcerans oxidoreductase 0.0062 0.066 0.8242
Loa Loa (eye worm) hypothetical protein 0.0029 0.018 0.0524
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Plasmodium falciparum ataxin-2 like protein, putative 0.0029 0.018 0.0815
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.0361 0.2799
Brugia malayi glutathione reductase 0.0072 0.0814 0.2366
Brugia malayi Fli-1 protein 0.0253 0.3438 1
Loa Loa (eye worm) beta-lactamase 0.0041 0.0361 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Trypanosoma brucei Nitroreductase family, putative 0.0062 0.066 0.0543
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.007 0.0775 0.0659
Toxoplasma gondii LsmAD domain-containing protein 0.0029 0.018 0.0815
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0361 0.0715
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.021 0.061
Entamoeba histolytica hypothetical protein 0.0062 0.066 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Leishmania major hypothetical protein, conserved 0.0029 0.018 0.0057
Trypanosoma brucei hypothetical protein, conserved 0.0041 0.0361 0.024
Loa Loa (eye worm) hypothetical protein 0.0071 0.0795 0.2311
Plasmodium vivax thioredoxin reductase, putative 0.0072 0.0814 1
Schistosoma mansoni intermediate filament proteins 0.0031 0.021 0.0259
Entamoeba histolytica nitroreductase family protein 0.0062 0.066 0.5
Brugia malayi beta-lactamase family protein 0.0041 0.0361 0.1049
Brugia malayi hypothetical protein 0.0019 0.0031 0.0089
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.007 0.0775 0.7687
Mycobacterium ulcerans esterase/lipase LipP 0.0041 0.0361 0.3642
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0361 0.024
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.021 0.061
Mycobacterium ulcerans nitroreductase 0.0062 0.066 0.8242
Leishmania major hypothetical protein, conserved 0.0062 0.066 0.0543
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0361 0.4419
Loa Loa (eye worm) hypothetical protein 0.0031 0.021 0.061
Loa Loa (eye worm) hypothetical protein 0.003 0.0201 0.0586
Brugia malayi beta-lactamase family protein 0.0041 0.0361 0.1049
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.018 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Trypanosoma brucei Nitroreductase family, putative 0.0062 0.066 0.0543
Leishmania major trypanothione reductase 0.0072 0.0814 0.0698
Mycobacterium ulcerans beta-lactamase 0.0041 0.0361 0.3642
Trypanosoma cruzi trypanothione reductase, putative 0.0072 0.0814 0.0698
Mycobacterium tuberculosis Conserved protein 0.0041 0.0361 0.068
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Mycobacterium ulcerans aldehyde dehydrogenase 0.007 0.0775 1
Toxoplasma gondii ABC1 family protein 0.0041 0.0361 0.3436
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Mycobacterium ulcerans hypothetical protein 0.0062 0.066 0.8242
Brugia malayi Ets-domain containing protein 0.0083 0.097 0.2822
Mycobacterium ulcerans lipase LipD 0.0041 0.0361 0.3642
Onchocerca volvulus 0.0041 0.0361 0.3357
Brugia malayi beta-lactamase 0.0041 0.0361 0.1049
Trichomonas vaginalis esterase, putative 0.0041 0.0361 0.4419
Loa Loa (eye worm) hypothetical protein 0.0041 0.0361 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0062 0.066 1
Mycobacterium tuberculosis Conserved protein 0.0041 0.0361 0.068
Schistosoma mansoni gabp alpha 0.0083 0.097 0.2554
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0361 0.0715
Echinococcus multilocularis lamin dm0 0.0031 0.021 0.1013
Brugia malayi Ets-domain containing protein 0.0083 0.097 0.2822
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.0361 0.4419
Plasmodium vivax ataxin-2 like protein, putative 0.0029 0.018 0.0815
Mycobacterium leprae Probable lipase LipE 0.0041 0.0361 0.4419
Entamoeba histolytica nitroreductase family protein 0.0062 0.066 0.5
Mycobacterium tuberculosis Conserved protein 0.0041 0.0361 0.068
Plasmodium falciparum thioredoxin reductase 0.0072 0.0814 1
Mycobacterium ulcerans nitroreductase 0.0062 0.066 0.8242
Trypanosoma cruzi PAB1-binding protein , putative 0.0029 0.018 0.0057
Trypanosoma brucei PAB1-binding protein , putative 0.0029 0.018 0.0057
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.0361 0.024
Schistosoma mansoni aldehyde dehydrogenase 0.007 0.0775 0.1963
Echinococcus granulosus lamin dm0 0.0031 0.021 0.1013
Mycobacterium ulcerans hypothetical protein 0.0041 0.0361 0.3642

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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