Detailed information for compound 1297094

Basic information

Technical information
  • TDR Targets ID: 1297094
  • Name: tert-butyl 4-[2-(3-fluorophenyl)-4-[[1-(pheny lmethyl)piperidin-4-yl]carbamoyl]pyrazol-3-yl ]piperidine-1-carboxylate
  • MW: 561.69 | Formula: C32H40FN5O3
  • H donors: 1 H acceptors: 3 LogP: 4.82 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 2
  • SMILES: Fc1cccc(c1)n1ncc(c1C1CCN(CC1)C(=O)OC(C)(C)C)C(=O)NC1CCN(CC1)Cc1ccccc1
  • InChi: 1S/C32H40FN5O3/c1-32(2,3)41-31(40)37-18-12-24(13-19-37)29-28(21-34-38(29)27-11-7-10-25(33)20-27)30(39)35-26-14-16-36(17-15-26)22-23-8-5-4-6-9-23/h4-11,20-21,24,26H,12-19,22H2,1-3H3,(H,35,39)
  • InChiKey: MQJXNZZEAUBJMF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • tert-butyl 4-[2-(3-fluorophenyl)-4-[[1-(phenylmethyl)-4-piperidyl]carbamoyl]pyrazol-3-yl]piperidine-1-carboxylate
  • 4-[2-(3-fluorophenyl)-4-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester
  • 4-[4-[[1-(benzyl)-4-piperidyl]carbamoyl]-2-(3-fluorophenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester
  • E955-1634
  • NCGC00127287-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens tumor protein p53 Starlite/ChEMBL No references
Homo sapiens K(lysine) acetyltransferase 2A Starlite/ChEMBL No references
Homo sapiens mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania major target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Plasmodium knowlesi histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium parvum GCN5 like acetylase + bromodomain Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania donovani Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Toxoplasma gondii target of rapamycin (TOR), putative Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 4-kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum Phosphatidylinositol 3-kinase tor2, related Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Theileria parva histone acetyltransferase Gcn5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Plasmodium vivax histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis tumor protein p63 Get druggable targets OG5_140038 All targets in OG5_140038
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania infantum target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0808 0.1959
Loa Loa (eye worm) acetyltransferase 0.0175 0.4125 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0054 0.108 0.23
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Mycobacterium ulcerans hypothetical protein 0.0043 0.0808 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Mycobacterium ulcerans beta-lactamase 0.0043 0.0808 0.5
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.4001 0.3897
Toxoplasma gondii ABC1 family protein 0.0043 0.0808 0.8003
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0529 0.4901
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0054 0.108 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0054 0.108 1
Onchocerca volvulus 0.006 0.1218 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0054 0.108 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0043 0.0801 0.6934
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.3347 0.8114
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0171 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.108 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0054 0.108 1
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.1009 0.9347
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0808 0.7008
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0529 0.4901
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0808 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0521 0.4826
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.045 0.4171
Loa Loa (eye worm) beta-lactamase 0.0043 0.0808 0.1959
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0054 0.108 0.0925
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.045 0.4171
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.08 0.7408
Toxoplasma gondii target of rapamycin (TOR), putative 0.004 0.0729 0.7225
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0808 0.7481
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0054 0.108 0.23
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0808 0.5
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0171 0.0413
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.1009 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0808 0.7481
Loa Loa (eye worm) hypothetical protein 0.006 0.1218 0.2952
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.4125 1
Giardia lamblia GTOR 0.0054 0.108 1
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.0901 0.5
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0054 0.108 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0054 0.108 0.0925
Mycobacterium ulcerans lipase LipD 0.0043 0.0808 0.5
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0808 0.1612
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0171 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0529 0.4901
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0808 0.7481
Trichomonas vaginalis esterase, putative 0.0043 0.0808 0.7481
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.4125 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.3347 0.8114
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0808 0.7008
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0808 0.1612
Mycobacterium leprae Probable lipase LipE 0.0043 0.0808 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0171 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.08 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0054 0.108 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0054 0.108 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.108 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.06 0.5555
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.1009 0.9347
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.4125 0.4023
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0808 0.7481
Schistosoma mansoni cellular tumor antigen P53 0.006 0.1218 0.2648
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0629 0.5829
Brugia malayi beta-lactamase 0.0043 0.0808 0.1612
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0808 0.7008
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.08 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0043 0.0801 0.6934
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0449 0.4161
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0054 0.108 1
Brugia malayi beta-lactamase family protein 0.0043 0.0808 0.1612
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0808 0.0648
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0449 0.4161
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0449 0.4161
Trypanosoma cruzi target of rapamycin kinase 3 0.0043 0.0801 0.6934
Brugia malayi beta-lactamase family protein 0.0043 0.0808 0.1612
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0808 0.1612
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.1009 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0015 0.0079 0.0729
Brugia malayi MH2 domain containing protein 0.0144 0.3347 0.8032
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0521 0.4826
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0808 0.0648
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0023 0.028 0.1204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.08 0.7408
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.1009 0.0853
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0171 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.108 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.045 0.4171
Leishmania major hypothetical protein, conserved 0.0043 0.0808 0.7008
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0729 0.6753
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0026 0.0359 0.207
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.6716 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Trichomonas vaginalis PIKK family atypical protein kinase 0.0046 0.088 0.8147
Loa Loa (eye worm) hypothetical protein 0.0043 0.0808 0.1959
Loa Loa (eye worm) phosphatidylinositol 3 0.0054 0.108 0.2618
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.08 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.0018 0.0171 0.1579
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0808 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0808 0.7481
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.1009 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.045 0.4171

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.5012 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) = 4.4668 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Nonpermissive Temperature. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 14.1254 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 14.6892 uM PUBCHEM_BIOASSAY: Acumen qHTS Assay for Inhibitors of the mTORC1 Signaling Pathway in MEF (Tsc2-/-, p53-/-) Cells: Sytravon. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2660, AID2666, AID2667, AID2668, AID2681, AID504465] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference

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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