Detailed information for compound 807630

Basic information

Technical information
  • TDR Targets ID: 807630
  • Name: (5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-phen ylmethanethione
  • MW: 234.317 | Formula: C12H14N2OS
  • H donors: 1 H acceptors: 1 LogP: 1.44 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: S=C(N1N=C(CC1(C)O)C)c1ccccc1
  • InChi: 1S/C12H14N2OS/c1-9-8-12(2,15)14(13-9)11(16)10-6-4-3-5-7-10/h3-7,15H,8H2,1-2H3
  • InChiKey: LTTLECARTGXYAT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (5-hydroxy-3,5-dimethyl-4H-pyrazol-1-yl)-phenyl-methanethione
  • CBMicro_009251
  • (5-Hydroxy-3,5-dimethyl-4,5-dihydro-pyrazol-1-yl)-phenyl-methanethione
  • BAS 01967832
  • BIM-0008997.P001

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
Schistosoma mansoni pyruvate kinase 0.0064 0.22 0.2392
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.053 0.1494
Loa Loa (eye worm) hypothetical protein 0.0093 0.355 0.4087
Schistosoma mansoni pyruvate kinase 0.0033 0.0723 0.0355
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Schistosoma mansoni hypothetical protein 0.0033 0.0723 0.0356
Brugia malayi neuropeptide F receptor 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0029 0.053 0.061
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Schistosoma mansoni high voltage-activated calcium channel Cav1 0.0085 0.3154 0.3708
Loa Loa (eye worm) hypothetical protein 0.0093 0.355 0.4087
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.053 0.0089
Echinococcus granulosus neuropeptide Y receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) pyruvate kinase 0.0064 0.22 0.2533
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus multilocularis pyruvate kinase 0.0064 0.22 0.2392
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi G-protein coupled receptor 0.0028 0.0465 0.0444
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0033 0.0723 0.0833
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0028 0.0465 0.0444
Echinococcus granulosus tm gpcr rhodopsin 0.0028 0.0465 0.0603
Echinococcus granulosus neuropeptides capa receptor 0.0028 0.0465 0.0603
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Schistosoma mansoni voltage-gated cation channel 0.0085 0.3154 0.3708
Brugia malayi Serotonin receptor 0.0028 0.0465 0.0444
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0033 0.0734 0.0951
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Plasmodium vivax pyruvate kinase 2, putative 0.0033 0.0723 0.1152
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi Pyruvate kinase, muscle isozyme 0.0064 0.22 0.2461
Loa Loa (eye worm) pyruvate kinase 0.0064 0.22 0.2533
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) G-protein coupled receptor 0.0028 0.0465 0.0536
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus neuropeptide receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0093 0.355 0.4087
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi RE15519p 0.0028 0.0465 0.0444
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi Pre-SET motif family protein 0.0029 0.053 0.052
Echinococcus granulosus pyruvate kinase 0.0064 0.22 0.2851
Echinococcus granulosus sex peptide receptor 0.0028 0.0465 0.0603
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Toxoplasma gondii hypothetical protein 0.0093 0.355 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi larval opioid receptor 0.0028 0.0465 0.0444
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.0033 0.0734 0.122
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus orexin receptor type 2 0.0028 0.0465 0.0603
Echinococcus granulosus tm gpcr rhodopsin 0.0028 0.0465 0.0603
Trypanosoma cruzi pyruvate kinase 2, putative 0.0064 0.22 1
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Echinococcus multilocularis pyruvate kinase 0.0064 0.22 0.2392
Echinococcus granulosus voltage gated sodium channel Nav1 alpha subunit 0.0036 0.0857 0.1111
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Echinococcus multilocularis pyruvate kinase 0.0033 0.0723 0.0355
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Brugia malayi Pyruvate kinase, M2 isozyme 0.0064 0.22 0.2461
Loa Loa (eye worm) neuropeptide F receptor 0.0028 0.0465 0.0536
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus tachykinin peptides receptor 99D 0.0028 0.0465 0.0603
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Plasmodium falciparum pyruvate kinase 0.0064 0.22 1
Echinococcus granulosus g protein coupled receptor 0.0028 0.0465 0.0603
Schistosoma mansoni hypothetical protein 0.0182 0.7717 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0028 0.0465 0.0536
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.053 0.0089
Echinococcus granulosus hypothetical protein 0.0028 0.0465 0.0603
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.053 0.0089
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0085 0.3154 0.3708
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi putative neuropeptide receptor NPR1 0.0028 0.0465 0.0444
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0723 0.0744
Echinococcus multilocularis pyruvate kinase 0.0033 0.0723 0.0355
Loa Loa (eye worm) neuropeptide F receptor 0.0028 0.0465 0.0536
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0028 0.0465 0.0536
Trypanosoma brucei pyruvate kinase 1 0.0064 0.22 1
Brugia malayi sulfakinin receptor protein 0.0028 0.0465 0.0444
Loa Loa (eye worm) hepatopoietin HPO2 0.0033 0.0734 0.0845
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi G-protein coupled receptor 0.0028 0.0465 0.0444
Echinococcus granulosus pyruvate kinase 0.0033 0.0723 0.0936
Echinococcus granulosus G protein coupled receptor 139 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0045 0.1282 0.1476
Plasmodium vivax pyruvate kinase, putative 0.0064 0.22 1
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Brugia malayi GnHR receptor homolog 0.0028 0.0465 0.0444
Toxoplasma gondii Erv1 / Alr family protein 0.0033 0.0734 0.2067
Echinococcus granulosus g protein coupled receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) calcium channel 0.0085 0.3154 0.3632
Echinococcus granulosus neuropeptides capa receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0093 0.355 0.4087
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Leishmania major pyruvate kinase 0.0064 0.22 1
Echinococcus multilocularis sodium channel protein 0.0036 0.0857 0.054
Brugia malayi Serotonin receptor 0.0028 0.0465 0.0444
Trypanosoma brucei pyruvate kinase 1, putative 0.0064 0.22 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Onchocerca volvulus Pyruvate kinase homolog 0.0064 0.22 0.1819
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.053 0.0089
Loa Loa (eye worm) TYRA-2 protein 0.0028 0.0465 0.0536
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.048 0.0622
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0028 0.0465 0.0603
Brugia malayi G protein-coupled receptor 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus biogenic amine 5HT receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) pyruvate kinase-PB 0.0045 0.1282 0.1476
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0028 0.0465 0.0603
Echinococcus granulosus pyruvate kinase 0.0033 0.0723 0.0936
Echinococcus granulosus biogenic amine 5HT receptor 0.0028 0.0465 0.0603
Brugia malayi follicle stimulating hormone receptor 0.0028 0.0465 0.0444
Brugia malayi neuropeptide F receptor 0.0028 0.0465 0.0444
Echinococcus granulosus pyruvate kinase 0.0033 0.0723 0.0936
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.053 0.0089
Mycobacterium leprae Probable pyruvate kinase PykA 0.0064 0.22 0.5
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0033 0.0734 0.037
Brugia malayi Dopamine receptor protein 2 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus multilocularis voltage dependent calcium channel 0.0085 0.3154 0.3708
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Echinococcus granulosus fmrfamide receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0028 0.0465 0.0536
Echinococcus multilocularis voltage dependent L type calcium channel subunit 0.0085 0.3154 0.3708
Echinococcus granulosus voltage dependent L type calcium channel subunit|voltage dependent calcium channel 0.0085 0.3154 0.4087
Mycobacterium ulcerans pyruvate kinase 0.0064 0.22 0.5
Loa Loa (eye worm) G-protein coupled receptor 0.0028 0.0465 0.0536
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.1445 0.1583
Echinococcus granulosus tm gpcr rhodopsin 0.0028 0.0465 0.0603
Schistosoma mansoni pyruvate kinase 0.0064 0.22 0.2392
Trichomonas vaginalis set domain proteins, putative 0.023 1 1
Brugia malayi AKH receptor 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0064 0.22 0.2533
Echinococcus granulosus neuropeptide FF receptor 2 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel|voltage dependent L type calcium channel subu 0.0085 0.3154 0.4087
Onchocerca volvulus Pyruvate kinase homolog 0.0064 0.22 0.1819
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0028 0.0465 0.0603
Chlamydia trachomatis pyruvate kinase 0.0064 0.22 0.5
Entamoeba histolytica pyruvate kinase, putative 0.0045 0.1282 0.5
Echinococcus granulosus voltage dependent calcium channel 0.0085 0.3154 0.4087
Loa Loa (eye worm) hypothetical protein 0.0048 0.1445 0.1664
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0028 0.0465 0.0603
Loa Loa (eye worm) pyruvate kinase 0.0064 0.22 0.2533
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.1445 0.1664
Trypanosoma cruzi Voltage-dependent calcium channel subunit, putative 0.0052 0.1592 0.585
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.1445 0.1583
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0028 0.0465 0.0444
Brugia malayi Melatonin receptor type 1A 0.0028 0.0465 0.0444
Echinococcus multilocularis geminin 0.0182 0.7717 1
Echinococcus granulosus dro:myosuppressin receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi ORL1-like opioid receptor 0.0028 0.0465 0.0444
Echinococcus granulosus alpha 1A adrenergic receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus allatostatin A receptor 0.0028 0.0465 0.0603
Echinococcus granulosus neuropeptide receptor A26 0.0028 0.0465 0.0603
Brugia malayi G protein-coupled receptor F59B2.13 0.0028 0.0465 0.0444
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.053 0.0089
Echinococcus granulosus voltage dependent calcium channel type d subunit|voltage dependent calcium channel alpha 1 0.0085 0.3154 0.4087
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0028 0.0465 0.0444
Brugia malayi Dopamine receptor 0.0028 0.0465 0.0444
Brugia malayi Tachykinin-like peptides receptor 99D 0.0028 0.0465 0.0444
Leishmania major pyruvate kinase 0.0064 0.22 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0085 0.3154 0.3708
Echinococcus granulosus g protein coupled receptor 0.0028 0.0465 0.0603
Echinococcus granulosus peptide allatostatin:somatostatin 0.0028 0.0465 0.0603
Brugia malayi Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog 0.0085 0.3154 0.357
Brugia malayi hypothetical protein 0.0162 0.6791 0.7799
Echinococcus granulosus neuropeptide Y receptor 0.0028 0.0465 0.0603
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus multilocularis pyruvate kinase 0.0033 0.0723 0.0355
Trypanosoma cruzi pyruvate kinase 2, putative 0.0064 0.22 1
Echinococcus multilocularis voltage dependent calcium channel type d subunit 0.0085 0.3154 0.3708
Plasmodium falciparum FAD-linked sulfhydryl oxidase ERV1, putative 0.0033 0.0734 0.0076
Brugia malayi hypothetical protein 0.0028 0.0465 0.0444
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0064 0.22 0.5
Toxoplasma gondii Erv1 / Alr family protein 0.0033 0.0734 0.2067
Toxoplasma gondii pyruvate kinase PyK1 0.0064 0.22 0.6198
Schistosoma mansoni high voltage-activated calcium channel Cav2A 0.0085 0.3154 0.3708
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.8685 1
Toxoplasma gondii pyruvate kinase PyKII 0.0033 0.0723 0.2036
Echinococcus granulosus g-protein coupled receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0085 0.3154 0.3632
Brugia malayi Dopamine receptor protein 1 0.0028 0.0465 0.0444
Giardia lamblia Pyruvate kinase 0.0064 0.22 1
Echinococcus multilocularis pyruvate kinase 0.0051 0.156 0.151
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.053 0.0687
Echinococcus granulosus serotonin receptor 0.0028 0.0465 0.0603
Brugia malayi putative neuropeptide receptor 0.0028 0.0465 0.0444
Brugia malayi Augmenter of liver regeneration 0.0033 0.0734 0.0757
Echinococcus granulosus geminin 0.0182 0.7717 1
Echinococcus granulosus pyruvate kinase 0.0064 0.22 0.2851
Onchocerca volvulus Pyruvate kinase homolog 0.0064 0.22 0.1819
Echinococcus granulosus somatostatin receptor 0.0028 0.0465 0.0603
Echinococcus multilocularis voltage dependent calcium channel 0.0085 0.3154 0.3708
Echinococcus granulosus neuropeptide s receptor 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0162 0.6791 0.782
Onchocerca volvulus 0.0029 0.053 0.0068
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Loa Loa (eye worm) melatonin receptor type 1A 0.0028 0.0465 0.0536
Echinococcus granulosus 7TM GPCR rhodopsin 0.0028 0.0465 0.0603
Loa Loa (eye worm) hypothetical protein 0.0028 0.0465 0.0536
Echinococcus granulosus neuropeptide receptor 0.0028 0.0465 0.0603
Trypanosoma brucei Voltage-dependent calcium channel subunit, putative 0.0052 0.1592 0.585
Echinococcus granulosus rhodopsin orphan GPCR 0.0028 0.0465 0.0603
Echinococcus granulosus 7tm_1 domain containing protein 0.0028 0.0465 0.0603
Schistosoma mansoni hypothetical protein 0.0182 0.7717 1
Brugia malayi Pre-SET motif family protein 0.0202 0.8685 1
Onchocerca volvulus 0.0162 0.6791 0.6635

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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