Detailed information for compound 705447

Basic information

Technical information
  • TDR Targets ID: 705447
  • Name: 2-[ethyl-[1-phenyl-4-(phenylamino)pyrazolo[5, 4-d]pyrimidin-6-yl]amino]ethanol
  • MW: 374.439 | Formula: C21H22N6O
  • H donors: 2 H acceptors: 4 LogP: 3.86 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCCN(c1nc(Nc2ccccc2)c2c(n1)n(nc2)c1ccccc1)CC
  • InChi: 1S/C21H22N6O/c1-2-26(13-14-28)21-24-19(23-16-9-5-3-6-10-16)18-15-22-27(20(18)25-21)17-11-7-4-8-12-17/h3-12,15,28H,2,13-14H2,1H3,(H,23,24,25)
  • InChiKey: KRJWRGJQFPCEFW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[ethyl-[1-phenyl-4-(phenylamino)-6-pyrazolo[5,4-d]pyrimidinyl]amino]ethanol

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
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0058 0.0824 0.0824
Trichomonas vaginalis beta-galactosidase, putative 0.016 0.2543 0.5308
Echinococcus multilocularis neuropeptide s receptor 0.0461 0.7603 0.7603
Brugia malayi mbt repeat family protein 0.0051 0.0706 0.0706
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0303 0.0303
Brugia malayi Glycosyl hydrolases family 2, sugar binding domain containing protein 0.0056 0.0798 0.0798
Schistosoma mansoni lamin 0.0027 0.0303 0.0425
Schistosoma mansoni cpg binding protein 0.003 0.036 0.0522
Schistosoma mansoni beta-mannosidase 0.0052 0.0726 0.1151
Echinococcus multilocularis BC026374 protein (S09 family) 0.0061 0.0871 0.087
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0303 0.0302
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0056 0.0054
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0113 0.0113
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0013 0.0071 0.0069
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0628 0.0626
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0446 0.0444
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0333 0.0331
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Echinococcus granulosus SAM and MBT domain containing protein 0.0051 0.0706 0.0705
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0304 0.5
Echinococcus granulosus neuroligin 0.0061 0.0871 0.087
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0051 0.0706 0.1118
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0628 0.0626
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0628 0.0983
Echinococcus multilocularis polycomb protein SCMH1 0.0051 0.0706 0.0705
Brugia malayi hypothetical protein 0.0017 0.0145 0.0145
Schistosoma mansoni hypothetical protein 0.0035 0.0446 0.067
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0358 0.5876 1
Echinococcus multilocularis muscleblind protein 0.0603 1 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0058 0.0824 0.0823
Trichomonas vaginalis conserved hypothetical protein 0.016 0.2543 0.5308
Onchocerca volvulus 0.0061 0.0871 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.0295 0.0293
Echinococcus multilocularis lamin 0.0027 0.0303 0.0302
Loa Loa (eye worm) carboxylesterase 0.0061 0.0871 0.087
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0446 0.0444
Schistosoma mansoni hypothetical protein 0.0152 0.2404 0.4035
Loa Loa (eye worm) hypothetical protein 0.0013 0.0071 0.0069
Loa Loa (eye worm) hypothetical protein 0.0015 0.0113 0.0111
Trypanosoma brucei PAB1-binding protein , putative 0.0027 0.0304 0.5
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0061 0.0871 0.1401
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0869 0.1398
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0061 0.0871 0.5
Loa Loa (eye worm) hypothetical protein 0.0358 0.5876 0.5876
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0058 0.0824 0.0823
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0674 0.0672
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0628 0.0628
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0061 0.0871 0.0425
Loa Loa (eye worm) MBCTL1 0.0058 0.0824 0.0823
Brugia malayi hypothetical protein 0.0061 0.0871 0.0871
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0304 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0414 0.0414
Mycobacterium ulcerans carboxylesterase, LipT 0.0061 0.0871 0.5
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0051 0.0706 0.7094
Loa Loa (eye worm) beta-glucuronidase 0.0052 0.0726 0.0724
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0058 0.0824 0.0823
Loa Loa (eye worm) hypothetical protein 0.0051 0.0706 0.0705
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0061 0.0871 0.087
Echinococcus granulosus cpg binding protein 0.003 0.036 0.0358
Echinococcus granulosus para nitrobenzyl esterase 0.0061 0.0871 0.087
Brugia malayi mbt repeat family protein 0.0051 0.0706 0.0706
Loa Loa (eye worm) hypothetical protein 0.0012 0.0063 0.0061
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0303 0.0302
Schistosoma mansoni acetylcholinesterase 0.0061 0.0871 0.1401
Echinococcus multilocularis neuroligin 0.0061 0.0871 0.087
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0628 0.0626
Schistosoma mansoni intermediate filament proteins 0.0027 0.0303 0.0425
Loa Loa (eye worm) hypothetical protein 0.0027 0.0303 0.0302
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0674 0.0674
Echinococcus multilocularis carboxylesterase 5A 0.0358 0.5876 0.5876
Schistosoma mansoni hypothetical protein 0.0015 0.0113 0.0099
Echinococcus multilocularis neuropeptide receptor A26 0.0461 0.7603 0.7603
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0304 0.5
Schistosoma mansoni cpg binding protein 0.0028 0.0333 0.0476
Schistosoma mansoni lamin 0.0027 0.0303 0.0425
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0061 0.0871 0.087
Echinococcus granulosus histone acetyltransferase MYST2 0.0058 0.0824 0.0823
Schistosoma mansoni hypothetical protein 0.0015 0.0113 0.0099
Echinococcus multilocularis musashi 0.0027 0.0303 0.0302
Brugia malayi Carboxylesterase family protein 0.0061 0.0871 0.0871
Schistosoma mansoni gliotactin 0.0061 0.0871 0.1401
Loa Loa (eye worm) mbt repeat family protein 0.0051 0.0706 0.0705
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0061 0.0871 0.1401
Brugia malayi Carboxylesterase family protein 0.0061 0.0871 0.0871
Echinococcus granulosus carboxylesterase 5A 0.0358 0.5876 0.5876
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0013 0.0071 0.0069
Brugia malayi Carboxylesterase family protein 0.0358 0.5876 0.5876
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0113 0.0111
Echinococcus multilocularis para nitrobenzyl esterase 0.0061 0.0871 0.087
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0628 0.0626
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0628 0.0626
Loa Loa (eye worm) glycosyl hydrolase family 2 0.0056 0.0798 0.0797
Schistosoma mansoni cpg binding protein 0.003 0.036 0.0522
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0056 0.0054
Entamoeba histolytica beta-galactosidase, putative 0.0108 0.1671 1
Schistosoma mansoni hypothetical protein 0.0015 0.0113 0.0099
Loa Loa (eye worm) hypothetical protein 0.0012 0.0063 0.0061
Brugia malayi Carboxylesterase family protein 0.0061 0.0871 0.0871
Echinococcus granulosus endonuclease exonuclease phosphatase 0.02 0.3213 0.3212
Echinococcus granulosus muscleblind protein 0.0603 1 1
Onchocerca volvulus 0.0061 0.0871 1
Echinococcus granulosus acetylcholinesterase 0.0358 0.5876 0.5876
Onchocerca volvulus 0.0061 0.0871 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0674 0.0674
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0014 0.0095 0.0093
Loa Loa (eye worm) carboxylesterase 0.0061 0.0871 0.087
Brugia malayi hypothetical protein 0.0035 0.0446 0.0446
Echinococcus multilocularis SAM and MBT domain containing protein 0.0051 0.0706 0.0705
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Brugia malayi hypothetical protein 0.0027 0.0304 0.0304
Schistosoma mansoni hypothetical protein 0.0015 0.0113 0.0099
Echinococcus granulosus lamin dm0 0.0027 0.0303 0.0302
Echinococcus granulosus intermediate filament protein 0.0027 0.0303 0.0302
Echinococcus granulosus BC026374 protein S09 family 0.0061 0.0871 0.087
Loa Loa (eye worm) hypothetical protein 0.0603 1 1
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0061 0.0871 0.5
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0304 0.5
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0706 0.1118
Schistosoma mansoni neuroligin 3 (S09 family) 0.0061 0.0871 0.1401
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0113 0.0113
Mycobacterium tuberculosis Carboxylesterase LipT 0.0061 0.0871 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0628 0.0983
Loa Loa (eye worm) acetylcholinesterase 1 0.0358 0.5876 0.5876
Brugia malayi intermediate filament protein 0.0027 0.0303 0.0303
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Leishmania major hypothetical protein, conserved 0.0027 0.0304 0.5
Echinococcus multilocularis GPCR, family 2 0.0015 0.0113 0.0111
Brugia malayi Carboxylesterase family protein 0.0061 0.0871 0.0871
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.0761 1
Echinococcus granulosus polycomb protein SCMH1 0.0051 0.0706 0.0705
Echinococcus granulosus neuropeptide receptor A26 0.0461 0.7603 0.7603
Trichomonas vaginalis spcc417.12 protein, putative 0.0061 0.0871 0.0425
Loa Loa (eye worm) hypothetical protein 0.0027 0.0304 0.0302
Loa Loa (eye worm) hypothetical protein 0.0033 0.0414 0.0413
Echinococcus multilocularis muscleblind protein 1 0.0603 1 1
Echinococcus granulosus lamin 0.0027 0.0303 0.0302
Brugia malayi Carboxylesterase family protein 0.0358 0.5876 0.5876
Echinococcus granulosus GPCR family 2 0.0015 0.0113 0.0111
Onchocerca volvulus 0.0061 0.0871 1
Schistosoma mansoni BC026374 protein (S09 family) 0.0061 0.0871 0.1401
Echinococcus granulosus neuropeptide s receptor 0.0461 0.7603 0.7603
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0113 0.0111
Schistosoma mansoni myelin transcription factor 1 myt1 0.0058 0.0824 0.132
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0113 0.0111
Echinococcus multilocularis acetylcholinesterase 0.0358 0.5876 0.5876
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0113 0.0111
Echinococcus multilocularis lamin dm0 0.0027 0.0303 0.0302
Brugia malayi manba-prov protein 0.0052 0.0726 0.0726
Echinococcus multilocularis acetylcholinesterase 0.0358 0.5876 0.5876
Trichomonas vaginalis glycoside hydrolase, putative 0.0255 0.4149 1
Onchocerca volvulus 0.0051 0.0706 0.7094
Plasmodium vivax ataxin-2 like protein, putative 0.0027 0.0304 0.5
Brugia malayi Beta-glucuronidase precursor 0.0052 0.0726 0.0726
Loa Loa (eye worm) hypothetical protein 0.0058 0.0824 0.0823
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0628 0.0983
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Schistosoma mansoni sex comb on midleg homolog 0.0051 0.0706 0.1118
Onchocerca volvulus 0.0061 0.0871 1
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Loa Loa (eye worm) hypothetical protein 0.0358 0.5876 0.5876
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0446 0.067
Schistosoma mansoni hypothetical protein 0.0033 0.0414 0.0616
Brugia malayi cytoplasmic intermediate filament protein 0.0014 0.0095 0.0095
Loa Loa (eye worm) hypothetical protein 0.0049 0.0674 0.0672
Loa Loa (eye worm) carboxylesterase 0.0358 0.5876 0.5876
Echinococcus granulosus acetylcholinesterase 0.0358 0.5876 0.5876
Echinococcus multilocularis cpg binding protein 0.003 0.036 0.0358
Loa Loa (eye worm) hypothetical protein 0.0603 1 1
Schistosoma mansoni hypothetical protein 0.0308 0.5037 0.8557
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0113 0.0111
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.02 0.3213 0.3212
Onchocerca volvulus 0.0028 0.0333 0.0514
Loa Loa (eye worm) hypothetical protein 0.0061 0.0871 0.087
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0061 0.0871 0.1401
Brugia malayi CXXC zinc finger family protein 0.0028 0.0333 0.0333

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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