Detailed information for compound 1396714

Basic information

Technical information
  • TDR Targets ID: 1396714
  • Name: 1-[4-(4-chlorophenyl)piperazin-1-yl]-3-naphth alen-1-yloxypropan-2-ol
  • MW: 396.91 | Formula: C23H25ClN2O2
  • H donors: 1 H acceptors: 1 LogP: 4.78 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(CN1CCN(CC1)c1ccc(cc1)Cl)COc1cccc2c1cccc2
  • InChi: 1S/C23H25ClN2O2/c24-19-8-10-20(11-9-19)26-14-12-25(13-15-26)16-21(27)17-28-23-7-3-5-18-4-1-2-6-22(18)23/h1-11,21,27H,12-17H2
  • InChiKey: LNTLXTBBTXSOSV-UHFFFAOYSA-N  


Substructure search Similarity search

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Synonyms

  • 1-[4-(4-chlorophenyl)piperazin-1-yl]-3-(1-naphthyloxy)propan-2-ol
  • 1-[4-(4-chlorophenyl)-1-piperazinyl]-3-(1-naphthyloxy)propan-2-ol
  • 1-[4-(4-chlorophenyl)piperazin-1-yl]-3-naphthalen-1-yloxy-propan-2-ol
  • MLS000736919
  • NSC111210
  • NSC91397
  • MLS000737719
  • SMR000528427

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens K(lysine) acetyltransferase 2A Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Homo sapiens flap structure-specific endonuclease 1 Starlite/ChEMBL No references
Homo sapiens ataxin 2 Starlite/ChEMBL No references
Streptococcus pyogenes serotype M1 Streptokinase A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Babesia bovis NAC domain containing protein Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium falciparum flap endonuclease 1 Get druggable targets OG5_127472 All targets in OG5_127472
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma brucei gambiense flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Loa Loa (eye worm) flap endonuclease-1 Get druggable targets OG5_127472 All targets in OG5_127472
Trypanosoma congolense flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Leishmania major flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase 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
Trypanosoma brucei gambiense nascent polypeptide associated complex alpha subunit, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium yoelii basic transcription factor 3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Loa Loa (eye worm) acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania mexicana basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium knowlesi histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus flap endonuclease 1 Get druggable targets OG5_127472 All targets in OG5_127472
Plasmodium knowlesi basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium falciparum basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Loa Loa (eye worm) ICD-1 protein Get druggable targets OG5_127333 All targets in OG5_127333
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Entamoeba histolytica hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania donovani transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Cryptosporidium parvum BTF domain, basal transcription factor Get druggable targets OG5_127333 All targets in OG5_127333
Trypanosoma cruzi transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Entamoeba histolytica transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Babesia bovis XPG N-terminal domain and XPG I-region domain containing protein Get druggable targets OG5_127472 All targets in OG5_127472
Theileria parva transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium vivax flap endonuclease 1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Giardia lamblia Flap structure-specific endonuclease Get druggable targets OG5_127472 All targets in OG5_127472
Trypanosoma brucei transcription factor BTF3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Leishmania mexicana flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Trypanosoma cruzi transcription factor btf3, putative Get druggable targets OG5_127333 All targets in OG5_127333
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus multilocularis transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Entamoeba histolytica Flap nuclease, putative Get druggable targets OG5_127472 All targets in OG5_127472
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Toxoplasma gondii flap structure-specific endonuclease 1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Toxoplasma gondii NAC domain-containing protein Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus granulosus transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Brugia malayi beta-NAC-like protein Get druggable targets OG5_127333 All targets in OG5_127333
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium vivax histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to S. cerevisiae GAL4 enhancer protein EGD1 (YPL037C) subunit alpha of the nascent polypeptide-associated chaperone comp Get druggable targets OG5_127333 All targets in OG5_127333
Theileria parva flap endonuclease 1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Leishmania major basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus multilocularis flap endonuclease 1 Get druggable targets OG5_127472 All targets in OG5_127472
Leishmania braziliensis flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Theileria parva histone acetyltransferase Gcn5, putative 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
Schistosoma mansoni transcription factor btf3 Get druggable targets OG5_127333 All targets in OG5_127333
Leishmania infantum flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Leishmania donovani flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Plasmodium knowlesi flap endonuclease 1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Neospora caninum hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Schistosoma japonicum ko:K04799 flap endonuclease-1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to S. cerevisiae GAL4 enhancer protein EGD1 (YPL037C) subunit alpha of the nascent polypeptide-associated chaperone comp Get druggable targets OG5_127333 All targets in OG5_127333
Cryptosporidium parvum flap endonuclease 1 Get druggable targets OG5_127472 All targets in OG5_127472
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni flap endonuclease-1 Get druggable targets OG5_127472 All targets in OG5_127472
Brugia malayi Flap endonuclease-1 Get druggable targets OG5_127472 All targets in OG5_127472
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127333 All targets in OG5_127333
Neospora caninum flap endonuclease-1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum ko:K01527 nascent polypeptide-associated complex subunit beta, putative Get druggable targets OG5_127333 All targets in OG5_127333
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Plasmodium berghei transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative Get druggable targets OG5_127472 All targets in OG5_127472
Cryptosporidium hominis NAC domain protein Get druggable targets OG5_127333 All targets in OG5_127333
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium yoelii flap endonuclease-1-related Get druggable targets OG5_127472 All targets in OG5_127472
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium berghei flap endonuclease 1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Trichomonas vaginalis flap endonuclease-1, putative Get druggable targets OG5_127472 All targets in OG5_127472
Plasmodium vivax basic transcription factor 3b, putative Get druggable targets OG5_127333 All targets in OG5_127333
Leishmania infantum basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
Cryptosporidium hominis flap endonuclease 1 Get druggable targets OG5_127472 All targets in OG5_127472
Leishmania braziliensis basic transcription factor 3a, putative Get druggable targets OG5_127333 All targets in OG5_127333
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Trypanosoma brucei exonuclease, putative flap structure-specific endonuclease 1 380 aa 322 aa 24.5 %
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
Schistosoma mansoni ubiquitin-specific peptidase 44 (C19 family) 0.0026 0.0171 0.0171
Schistosoma mansoni ubiquitin-specific peptidase 5 (C19 family) 0.0026 0.0171 0.0171
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.025 0.5576 1
Loa Loa (eye worm) ubiquitin specific peptidase 39 0.0026 0.0171 0.0307
Onchocerca volvulus Histone deacetylase 10 homolog 0.0108 0.2147 1
Trypanosoma brucei histone deacetylase 2 0.0108 0.2147 0.2011
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.025 0.5576 1
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0031 0.03 0.0131
Entamoeba histolytica histone deacetylase, putative 0.025 0.5576 1
Trypanosoma cruzi histone deacetylase 1, putative 0.025 0.5576 1
Echinococcus multilocularis histone deacetylase 8 0.0108 0.2147 0.3793
Loa Loa (eye worm) hypothetical protein 0.0119 0.2422 0.4344
Trypanosoma brucei histone deacetylase, putative 0.0227 0.503 0.4943
Loa Loa (eye worm) acetyltransferase 0.0175 0.3772 0.6764
Echinococcus multilocularis histone deacetylase 6 0.0227 0.503 0.8885
Echinococcus multilocularis u4:u6.u5 tri snrnp associated protein 2 0.0026 0.0171 0.0302
Loa Loa (eye worm) BRCA1-associated protein 2 containing protein 0.0026 0.0171 0.0307
Trypanosoma cruzi histone deacetylase 1, putative 0.025 0.5576 1
Echinococcus multilocularis histone deacetylase 7 0.0227 0.503 0.8885
Brugia malayi hypothetical protein 0.002 0.0015 0.0026
Loa Loa (eye worm) ICD-1 protein 0.0042 0.056 0.1005
Echinococcus multilocularis flap endonuclease 1 0.0031 0.03 0.053
Echinococcus granulosus histone deacetylase 6 0.0227 0.503 0.8885
Loa Loa (eye worm) hypothetical protein 0.0145 0.3054 0.5476
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0026 0.0171 0.0307
Brugia malayi Histone deacetylase family protein 0.0227 0.503 0.902
Schistosoma mansoni family C19 non-peptidase homologue (C19 family) 0.0026 0.0171 0.0171
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.3772 0.6662
Loa Loa (eye worm) hypothetical protein 0.0108 0.2147 0.385
Giardia lamblia Histone deacetylase 0.025 0.5576 1
Trichomonas vaginalis flap endonuclease-1, putative 0.0031 0.03 0.0238
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.056 0.072
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0995 0.1784
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0275 0.0193
Loa Loa (eye worm) histone deacetylase 11 0.0108 0.2147 0.385
Leishmania major histone deacetylase, putative 0.0227 0.503 0.8989
Echinococcus granulosus histone deacetylase 7 0.0227 0.503 0.8885
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0031 0.03 0.0238
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.3772 0.3772
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.068 0.0942
Leishmania major histone deacetylase, putative 0.0227 0.503 0.8989
Echinococcus granulosus histone deacetylase 1 0.025 0.5576 0.985
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.056 0.072
Leishmania major hypothetical protein, conserved 0.003 0.0275 0.0193
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 5 0.0026 0.0171 0.0302
Trypanosoma brucei histone deacetylase 4 0.0227 0.503 0.4943
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.056 0.072
Brugia malayi histone deacetylase 1 (HD1) 0.025 0.5576 1
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0275 0.0193
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0995 0.1784
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0026 0.0171 0.0307
Trypanosoma cruzi transcription factor btf3, putative 0.0042 0.056 0.072
Entamoeba histolytica Flap nuclease, putative 0.0031 0.03 0.0238
Plasmodium vivax histone deacetylase 2, putative 0.0227 0.503 0.8989
Plasmodium falciparum basic transcription factor 3b, putative 0.0042 0.056 0.072
Brugia malayi hypothetical protein 0.003 0.0275 0.0494
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.0784 0.1134
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.0784 0.1134
Schistosoma mansoni histone deacetylase 4 5 0.0227 0.503 0.503
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0031 0.03 0.0238
Plasmodium falciparum histone deacetylase, putative 0.0227 0.503 0.8989
Schistosoma mansoni histone deacetylase hda2 0.0108 0.2147 0.2147
Trypanosoma cruzi histone deacetylase, putative 0.0227 0.503 0.8989
Brugia malayi histone deacetylase 11 0.0108 0.2147 0.385
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0275 0.0193
Schistosoma mansoni transcription factor btf3 0.0042 0.056 0.056
Toxoplasma gondii histone deacetylase HDAC3 0.025 0.5576 1
Echinococcus granulosus BRCA1 associated protein 0.0026 0.0171 0.0302
Leishmania major histone deacetylase, putative 0.025 0.5576 1
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 22 0.0026 0.0171 0.0302
Loa Loa (eye worm) histone deacetylase 3 0.025 0.5576 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0534 0.0958
Schistosoma mansoni histone deacetylase 4 5 0.0227 0.503 0.503
Loa Loa (eye worm) hypothetical protein 0.006 0.0995 0.1784
Plasmodium vivax flap endonuclease 1, putative 0.0031 0.03 0.0238
Schistosoma mansoni histone deacetylase 0.025 0.5576 0.5576
Trypanosoma brucei histone deacetylase 3 0.0227 0.503 0.4943
Echinococcus multilocularis histone deacetylase 1 0.025 0.5576 0.985
Brugia malayi MH2 domain containing protein 0.0144 0.3025 0.5425
Loa Loa (eye worm) flap endonuclease-1 0.0031 0.03 0.0538
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Brugia malayi beta-NAC-like protein 0.0042 0.056 0.1005
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.3772 0.6764
Plasmodium falciparum histone deacetylase 1 0.025 0.5576 1
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0275 0.0193
Schistosoma mansoni brca1-associated protein (brap2) 0.0026 0.0171 0.0171
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0026 0.0171 0.0307
Trypanosoma cruzi histone deacetylase, putative 0.0108 0.2147 0.3656
Trypanosoma cruzi histone deacetylase, putative 0.0227 0.503 0.8989
Echinococcus granulosus transcription factor btf3 0.0042 0.056 0.099
Toxoplasma gondii histone deacetylase HDAC5 0.0108 0.2147 0.3656
Trypanosoma cruzi transcription factor btf3, putative 0.0042 0.056 0.072
Echinococcus granulosus histone deacetylase 8 0.0108 0.2147 0.3793
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0026 0.0171 0.0307
Brugia malayi Flap endonuclease-1 0.0031 0.03 0.0538
Echinococcus granulosus histone deacetylase 0.0227 0.503 0.8885
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.3653 0.6452
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.3025 0.5425
Entamoeba histolytica transcription factor BTF3, putative 0.0042 0.056 0.072
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.0784 0.1134
Leishmania major histone deacetylase, putative 0.025 0.5576 1
Brugia malayi histone deacetylase 3 (HD3) 0.025 0.5576 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.3025 0.5425
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Trypanosoma brucei transcription factor BTF3, putative 0.0042 0.056 0.0396
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.025 0.5576 1
Entamoeba histolytica hypothetical protein 0.0042 0.056 0.072
Plasmodium vivax histone deacetylase, putative 0.0227 0.503 0.8989
Echinococcus granulosus flap endonuclease 1 0.0031 0.03 0.053
Trypanosoma cruzi histone deacetylase, putative 0.0227 0.503 0.8989
Plasmodium vivax histone deacetylase, putative 0.0108 0.2147 0.3656
Plasmodium vivax histone deacetylase 1, putative 0.025 0.5576 1
Schistosoma mansoni histone deacetylase 1 2 3 0.0108 0.2147 0.2147
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0275 0.0106
Brugia malayi Histone deacetylase family protein 0.0227 0.503 0.902
Schistosoma mansoni histone deacetylase 0.025 0.5576 0.5576
Schistosoma mansoni brca1-associated protein (brap2) 0.0026 0.0171 0.0171
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0026 0.0171 0.0307
Echinococcus granulosus histone deacetylase 3 0.025 0.5576 0.985
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.0784 0.1134
Echinococcus multilocularis histone deacetylase 6 0.0253 0.5661 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0047 0.068 0.0942
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0534 0.0958
Echinococcus multilocularis histone deacetylase 6 0.0227 0.503 0.8885
Schistosoma mansoni histone deacetylase hda2 0.0253 0.5661 0.5661
Schistosoma mansoni hypothetical protein 0.0041 0.0534 0.0534
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.0784 0.1134
Giardia lamblia Flap structure-specific endonuclease 0.0031 0.03 0.0238
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0275 0.0193
Plasmodium falciparum flap endonuclease 1 0.0031 0.03 0.0238
Toxoplasma gondii histone deacetylase HDAC4 0.0108 0.2147 0.3656
Brugia malayi BRCA1-associated protein 2 containing protein 0.0026 0.0171 0.0307
Loa Loa (eye worm) histone deacetylase 0.0227 0.503 0.902
Toxoplasma gondii histone deacetylase HDAC1 0.0227 0.503 0.8989
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0995 0.1784
Brugia malayi Histone deacetylase 1 0.025 0.5576 1
Loa Loa (eye worm) hypothetical protein 0.025 0.5576 1
Echinococcus multilocularis transcription factor btf3 0.0042 0.056 0.099
Toxoplasma gondii histone deacetylase HDAC2 0.025 0.5576 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0031 0.03 0.0238
Schistosoma mansoni flap endonuclease-1 0.0028 0.0227 0.0227
Plasmodium falciparum histone deacetylase 2 0.0227 0.503 0.8989
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 22 0.0026 0.0171 0.0302
Echinococcus multilocularis histone deacetylase 0.0227 0.503 0.8885
Trypanosoma brucei histone deacetylase 1 0.025 0.5576 0.5499
Echinococcus multilocularis histone deacetylase 3 0.025 0.5576 0.985
Echinococcus granulosus u4:u6.u5 tri snrnp associated protein 2 0.0026 0.0171 0.0302
Echinococcus granulosus histone deacetylase 6 0.0227 0.503 0.8885
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Leishmania major basic transcription factor 3a, putative 0.0042 0.056 0.072
Echinococcus multilocularis BRCA1 associated protein 0.0026 0.0171 0.0302
Trypanosoma cruzi histone deacetylase, putative 0.0108 0.2147 0.3656
Loa Loa (eye worm) histone deacetylase 1 0.025 0.5576 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.0784 0.1385
Toxoplasma gondii NAC domain-containing protein 0.0042 0.056 0.072
Loa Loa (eye worm) histone deacetylase 7A 0.0227 0.503 0.902
Echinococcus granulosus histone deacetylase 6 0.0253 0.5661 1
Giardia lamblia Histone acetyltransferase GCN5 0.0047 0.068 0.0942
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0026 0.0171 0.0307
Loa Loa (eye worm) hypothetical protein 0.003 0.0275 0.0494
Trichomonas vaginalis histone deacetylase, putative 0.025 0.5576 1
Plasmodium vivax basic transcription factor 3b, putative 0.0042 0.056 0.072
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0275 0.0193

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 15.38 um PUBCHEM_BIOASSAY: Luminescence Microorganism-Based Dose Confirmation HTS to Identify Inhibitors of Streptokinase Promotor Activity. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1662 (Primary HTS)] ChEMBL. No reference
EC50 (functional) = 31.07 um PUBCHEM_BIOASSAY: Absorbance Microorganism-Based Dose Response HTS to Identify Inhibitors of Streptokinase Expression. (Class of assay: confirmatory) [Related pubchem assays: 1677 (Project Summary), 1902 (Retest at Dose), 1900 (Counter Screen), 1662 (Primary HTS)] ChEMBL. No reference
Potency (functional) 0.9285 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 2.8184 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) 14.1254 uM PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Human Flap endonuclease 1 (FEN1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488813] ChEMBL. No reference
Potency (functional) 15.8489 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) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 22.3872 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
Potency (functional) = 25.1189 um PUBCHEM_BIOASSAY: qHTS Assay for Small Molecule Inhibitors of Mitochondrial Division or Activators of Mitochondrial Fusion. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Activators of N370S glucocerebrosidase as a Potential Chaperone Treatment of Gaucher Disease. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1473, AID2293, AID2577, AID2578, AID2587, AID2588, AID2589, AID2590, AID2592, AID2593, AID2595, AID2596, AID2597, AID2613, AID2671, AID488845] ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (binding) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Vif-A3F Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 36.5365 uM PUBCHEM_BIOASSAY: qHTS of small molecules that selectively kill Giardia lamblia: Hit Validation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID540272] ChEMBL. No reference
Potency (functional) 44.6684 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 44.6684 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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