Detailed information for compound 1363769

Basic information

Technical information
  • TDR Targets ID: 1363769
  • Name: N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-yle thyl]-N-phenyl-N'-pyridin-3-ylbutanediamide
  • MW: 471.551 | Formula: C27H29N5O3
  • H donors: 2 H acceptors: 5 LogP: 2.19 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1cccnc1)CCC(=O)N(C(c1ccncc1)C(=O)NC1CCCC1)c1ccccc1
  • InChi: 1S/C27H29N5O3/c33-24(30-22-9-6-16-29-19-22)12-13-25(34)32(23-10-2-1-3-11-23)26(20-14-17-28-18-15-20)27(35)31-21-7-4-5-8-21/h1-3,6,9-11,14-19,21,26H,4-5,7-8,12-13H2,(H,30,33)(H,31,35)
  • InChiKey: YOMXELLBZGOMRO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-phenyl-N'-(3-pyridyl)butanediamide
  • N-[2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl]-N-phenyl-N'-(3-pyridyl)succinamide
  • N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-yl-ethyl]-N-phenyl-N'-pyridin-3-yl-butanediamide
  • MLS000880360
  • MLS000032634
  • N-(Cyclopentylcarbamoyl-pyridin-4-yl-methyl)-N-phenyl-N'-pyridin-3-yl-succinamide
  • ASN 06086232
  • SMR000006109

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 gliotactin 0.0057 0.0297 0.0297
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Echinococcus granulosus neuropeptide s receptor 0.0539 0.409 0.409
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0026 0.0049 0.009
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0258 0.1877 0.3429
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0057 0.0297 0.0297
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0714 0.5475 1
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Schistosoma mansoni hypothetical protein 0.005 0.0238 0.0238
Loa Loa (eye worm) norepinephrine transporter 0.0088 0.054 0.0987
Schistosoma mansoni BC026374 protein (S09 family) 0.0057 0.0297 0.0297
Echinococcus granulosus glutamate receptor subunit protein glur 0.0074 0.0432 0.0432
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0378 0.2829 0.2829
Echinococcus multilocularis inositol monophosphatase 1 0.0042 0.0176 0.0176
Loa Loa (eye worm) acetylcholinesterase 1 0.0339 0.2517 0.4598
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0633 0.4832 0.8826
Schistosoma mansoni hypothetical protein 0.0074 0.0432 0.0432
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Loa Loa (eye worm) hypothetical protein 0.0088 0.054 0.0987
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0074 0.0432 0.0432
Echinococcus granulosus lamin dm0 0.0031 0.0086 0.0086
Onchocerca volvulus 0.0026 0.0049 0.0088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.0994 0.0994
Loa Loa (eye worm) hypothetical protein 0.0158 0.1087 0.1985
Schistosoma mansoni hypothetical protein 0.0108 0.0694 0.0694
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0026 0.0049 0.0049
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.019 0.1344 0.1344
Brugia malayi Glutamate receptor 1 precursor 0.0164 0.1141 0.2083
Entamoeba histolytica hypothetical protein 0.0027 0.0058 0.3291
Schistosoma mansoni glutamate receptor AMPA 0.0164 0.1141 0.1141
Loa Loa (eye worm) hypothetical protein 0.0092 0.0574 0.1048
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0026 0.0049 0.0049
Loa Loa (eye worm) hypothetical protein 0.009 0.0556 0.1016
Brugia malayi Pre-SET motif family protein 0.0092 0.0574 0.1048
Entamoeba histolytica serine carboxypeptidase (S28) family protein 0.002 0.0001 0.0033
Loa Loa (eye worm) hypothetical protein 0.0339 0.2517 0.4598
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0026 0.0049 0.009
Echinococcus granulosus glutamate receptor 2 0.0116 0.0758 0.0758
Schistosoma mansoni hypothetical protein 0.005 0.0238 0.0238
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0176 0.0321
Echinococcus granulosus acetylcholinesterase 0.0339 0.2517 0.2517
Brugia malayi Carboxylesterase family protein 0.0339 0.2517 0.4598
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0092 0.0574 0.4695
Schistosoma mansoni protein kinase 0.0026 0.0049 0.0049
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Brugia malayi Glutamate receptor 2 precursor 0.0164 0.1141 0.2083
Loa Loa (eye worm) cytochrome P450 family protein 0.0022 0.0018 0.0033
Echinococcus granulosus glutamate receptor NMDA 0.0153 0.1051 0.1051
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0044 0.008
Echinococcus granulosus Lysosomal Pro X carboxypeptidase 0.009 0.0556 0.0556
Trichomonas vaginalis set domain proteins, putative 0.072 0.5519 1
Echinococcus granulosus para nitrobenzyl esterase 0.0057 0.0297 0.0297
Echinococcus multilocularis neuroligin 0.0057 0.0297 0.0297
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.125 0.2266
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0057 0.0297 0.0297
Loa Loa (eye worm) carboxylesterase 0.0057 0.0297 0.0542
Onchocerca volvulus 0.0057 0.0297 0.0537
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Echinococcus multilocularis tyrosine kinase 0.0026 0.0049 0.0049
Schistosoma mansoni cpg binding protein 0.0096 0.0599 0.0599
Echinococcus multilocularis acetylcholinesterase 0.0339 0.2517 0.2517
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Brugia malayi Latrophilin receptor protein 2 0.005 0.0238 0.0435
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0027 0.0058 0.0058
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0026 0.0049 0.009
Trichomonas vaginalis spcc417.12 protein, putative 0.0057 0.0297 0.0538
Onchocerca volvulus 0.0031 0.0086 0.0156
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0339 0.2517 0.2517
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Loa Loa (eye worm) hypothetical protein 0.009 0.0556 0.1016
Onchocerca volvulus Glucosylceramidase homolog 0.0169 0.1179 0.2135
Brugia malayi Metabotropic glutamate receptor precursor. 0.0026 0.0049 0.009
Echinococcus granulosus glutamate receptor 2 0.019 0.1344 0.1344
Trichomonas vaginalis helicase, putative 0.002 0.0007 0.0012
Onchocerca volvulus 0.0031 0.0086 0.0156
Brugia malayi latrophilin 2 splice variant baaae 0.0108 0.0694 0.1268
Echinococcus granulosus neuroligin 0.0057 0.0297 0.0297
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0026 0.0049 0.0049
Schistosoma mansoni inositol monophosphatase 0.0042 0.0176 0.0176
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.005 0.0238 0.0238
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0026 0.0049 0.0049
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Loa Loa (eye worm) hypothetical protein 0.009 0.0556 0.1016
Echinococcus granulosus carboxylesterase 5A 0.0339 0.2517 0.2517
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0574 0.0574
Echinococcus multilocularis glutamate receptor 2 0.0116 0.0758 0.0758
Loa Loa (eye worm) hypothetical protein 0.0418 0.3141 0.5738
Schistosoma mansoni acetylcholinesterase 0.0057 0.0297 0.0297
Schistosoma mansoni tyrosine kinase 0.0026 0.0049 0.0049
Giardia lamblia Thymus-specific serine protease precursor 0.002 0.0001 1
Leishmania major hypothetical protein, conserved 0.0025 0.0044 0.008
Schistosoma mansoni inositol monophosphatase 0.0042 0.0176 0.0176
Schistosoma mansoni hypothetical protein 0.1288 1 1
Schistosoma mansoni lamin 0.0031 0.0086 0.0086
Schistosoma mansoni cpg binding protein 0.0096 0.0599 0.0599
Brugia malayi Carboxylesterase family protein 0.0057 0.0297 0.0542
Schistosoma mansoni lamin 0.0031 0.0086 0.0086
Echinococcus granulosus metabotropic glutamate receptor 2 0.0026 0.0049 0.0049
Schistosoma mansoni hypothetical protein 0.0535 0.4065 0.4065
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0026 0.0049 0.0049
Loa Loa (eye worm) CXXC zinc finger family protein 0.009 0.0558 0.102
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Brugia malayi MH2 domain containing protein 0.0122 0.081 0.148
Brugia malayi Carboxylesterase family protein 0.0057 0.0297 0.0542
Brugia malayi Receptor family ligand binding region containing protein 0.0026 0.0049 0.009
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0031 0.0092 0.0092
Schistosoma mansoni cpg binding protein 0.009 0.0558 0.0558
Schistosoma mansoni hypothetical protein 0.0055 0.0277 0.0277
Loa Loa (eye worm) hypothetical protein 0.0023 0.0028 0.0051
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0074 0.0432 0.0432
Brugia malayi Receptor family ligand binding region containing protein 0.0026 0.0049 0.009
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Loa Loa (eye worm) serotonin transporter b 0.0088 0.054 0.0987
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.019 0.1344 0.1344
Trichomonas vaginalis PIKK family atypical protein kinase 0.0027 0.0058 0.0105
Giardia lamblia Serine peptidase, putative 0.002 0.0001 1
Loa Loa (eye worm) hypothetical protein 0.0418 0.3141 0.5738
Leishmania major C-8 sterol isomerase-like protein 0.0714 0.5475 1
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0055 0.0282 0.904
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0057 0.0297 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0158 0.1087 0.1985
Echinococcus granulosus metabotropic glutamate receptor 5 0.0026 0.0049 0.0049
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0176 0.0321
Treponema pallidum sodium- and chloride- dependent transporter 0.0088 0.054 1
Entamoeba histolytica serine carboxypeptidase (S28) family protein 0.002 0.0001 0.0033
Brugia malayi CXXC zinc finger family protein 0.009 0.0558 0.102
Mycobacterium tuberculosis Carboxylesterase LipT 0.0057 0.0297 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.0994 0.0994
Echinococcus granulosus neuropeptide receptor A26 0.0539 0.409 0.409
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Echinococcus multilocularis GPCR, family 2 0.005 0.0238 0.0238
Chlamydia trachomatis glutamine binding protein 0.0055 0.0282 0.5
Echinococcus multilocularis musashi 0.0031 0.0086 0.0086
Trypanosoma cruzi serine carboxypeptidase S28, putative 0.002 0.0001 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Echinococcus granulosus histone lysine methyltransferase setb 0.0092 0.0574 0.0574
Onchocerca volvulus 0.0057 0.0297 0.0537
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Echinococcus multilocularis serine protein kinase ATM 0.0027 0.0058 0.0058
Schistosoma mansoni glutamate receptor NMDA 0.0343 0.255 0.255
Echinococcus granulosus Lysosomal Pro X carboxypeptidase 0.002 0.0001 0.0001
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0055 0.0277 0.0505
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.019 0.1344 0.1344
Trichomonas vaginalis prolylcarboxypeptidase, putative 0.002 0.0001 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Loa Loa (eye worm) hypothetical protein 0.0714 0.5475 1
Onchocerca volvulus 0.0057 0.0297 0.0537
Brugia malayi Cytochrome P450 family protein 0.0022 0.0018 0.0033
Echinococcus multilocularis lamin dm0 0.0031 0.0086 0.0086
Echinococcus multilocularis glutamate receptor 2 0.0164 0.1141 0.1141
Echinococcus multilocularis NMDA receptor 0.0074 0.0432 0.0432
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0176 0.0321
Brugia malayi Serine protease Z688.6 precursor 0.002 0.0001 0.0001
Loa Loa (eye worm) RGC/RGC protein kinase 0.0026 0.0049 0.009
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0158 0.1087 0.1985
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.005 0.0238 0.0238
Onchocerca volvulus 0.072 0.5519 1
Loa Loa (eye worm) intermediate filament protein 0.0031 0.0086 0.0158
Schistosoma mansoni ATP-binding cassette transporter 0.0164 0.1141 0.1141
Echinococcus granulosus survival motor neuron protein 1 0.0268 0.196 0.196
Toxoplasma gondii serine carboxypeptidase s28 protein 0.002 0.0001 0.0005
Echinococcus multilocularis nmda type glutamate receptor 0.0179 0.1255 0.1255
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0146 0.0994 0.1816
Loa Loa (eye worm) hypothetical protein 0.003 0.0082 0.015
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0031 0.0092 0.0092
Onchocerca volvulus 0.0092 0.0574 0.1039
Brugia malayi Carboxylesterase family protein 0.0339 0.2517 0.4598
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0044 0.0357
Echinococcus granulosus tyrosine kinase 0.0026 0.0049 0.0049
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Brugia malayi Guanylyl cyclase protein 23 0.0026 0.0049 0.009
Brugia malayi intermediate filament protein 0.0031 0.0086 0.0158
Onchocerca volvulus 0.0057 0.0297 0.0537
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0057 0.0297 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0044 0.008
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.019 0.1344 0.1344
Brugia malayi Carboxylesterase family protein 0.0057 0.0297 0.0542
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Loa Loa (eye worm) hypothetical protein 0.0088 0.054 0.0987
Brugia malayi Serine protease Z688.6 precursor 0.002 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0025 0.0044 0.008
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.0994 0.0994
Schistosoma mansoni glutamate receptor kainate 0.0164 0.1141 0.1141
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0088 0.054 0.0987
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0057 0.0297 0.0297
Schistosoma mansoni intermediate filament proteins 0.0031 0.0086 0.0086
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Echinococcus granulosus nmda type glutamate receptor 0.0283 0.2074 0.2074
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.0086 0.0158
Echinococcus multilocularis serotonin transporter 0.0088 0.054 0.054
Loa Loa (eye worm) hypothetical protein 0.0339 0.2517 0.4598
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.005 0.0238 0.0238
Schistosoma mansoni metabotropic glutamate receptor 0.0026 0.0049 0.0049
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0146 0.0994 0.0994
Echinococcus granulosus mixed lineage leukemia protein mll 0.0026 0.0049 0.0049
Loa Loa (eye worm) solute carrier family 6 member 4 0.0088 0.054 0.0987
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Loa Loa (eye worm) hypothetical protein 0.005 0.0238 0.0435
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0195 0.1384 0.1384
Leishmania major phosphatidylinositol kinase related protein, putative 0.002 0 0.0001
Schistosoma mansoni glutamate receptor kainate 0.0164 0.1141 0.1141
Echinococcus granulosus lamin 0.0031 0.0086 0.0086
Mycobacterium ulcerans carboxylesterase, LipT 0.0057 0.0297 1
Loa Loa (eye worm) hypothetical protein 0.0365 0.2722 0.4973
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Loa Loa (eye worm) transcription factor SMAD2 0.0122 0.081 0.148
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0042 0.0176 1
Brugia malayi hypothetical protein 0.0025 0.0044 0.008
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Echinococcus granulosus BC026374 protein S09 family 0.0057 0.0297 0.0297
Loa Loa (eye worm) carboxylesterase 0.0339 0.2517 0.4598
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Brugia malayi F/Y-rich N-terminus family protein 0.0031 0.0089 0.0163
Echinococcus granulosus intermediate filament protein 0.0031 0.0086 0.0086
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0027 0.0058 0.0106
Brugia malayi hypothetical protein 0.0057 0.0297 0.0542
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.019 0.1344 0.1344
Echinococcus granulosus serine protein kinase ATM 0.0027 0.0058 0.0058
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0574 0.0574
Schistosoma mansoni sodium/chloride dependent transporter 0.0088 0.054 0.054
Schistosoma mansoni survival motor neuron protein 0.0055 0.0277 0.0277
Schistosoma mansoni hypothetical protein 0.0535 0.4065 0.4065
Brugia malayi ERG2 and Sigma1 receptor like protein 0.0714 0.5475 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0297 0.0542
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0074 0.0432 0.0432
Brugia malayi hypothetical protein 0.0268 0.196 0.358
Echinococcus multilocularis neuropeptide s receptor 0.0539 0.409 0.409
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.002 0.0007 0.0012
Schistosoma mansoni hypothetical protein 0.005 0.0238 0.0238
Brugia malayi hypothetical protein 0.0026 0.0049 0.009
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.013 0.0868 0.0868
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.019 0.1344 0.1344
Toxoplasma gondii histone lysine methyltransferase SET1 0.0175 0.1222 1
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0074 0.0432 0.0432
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.0086 0.0158
Schistosoma mansoni tyrosine kinase 0.0026 0.0049 0.0049
Echinococcus multilocularis nmda type glutamate receptor 0.0283 0.2074 0.2074
Echinococcus multilocularis geminin 0.0535 0.4065 0.4065
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0057 0.0297 0.0297
Echinococcus granulosus atrial natriuretic peptide receptor 0.0026 0.0049 0.0049
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0001 0.0001
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0026 0.0049 0.0049
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Loa Loa (eye worm) glutamate receptor 2 0.0164 0.1141 0.2083
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Trypanosoma cruzi extracellular receptor, putative 0.0026 0.0049 0.009
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0146 0.0994 0.1816
Brugia malayi Inositol-1 0.0042 0.0176 0.0321
Echinococcus multilocularis Lysosomal Pro X carboxypeptidase 0.009 0.0556 0.0556
Onchocerca volvulus 0.009 0.0558 0.1011
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0038 0.0141 0.5
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Echinococcus multilocularis glutamate receptor 2 0.019 0.1344 0.1344
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0055 0.0282 0.8766
Loa Loa (eye worm) hypothetical protein 0.002 0.0001 0.0001
Trichomonas vaginalis prolylcarboxypeptidase, putative 0.002 0.0001 0.0001
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0042 0.0176 0.1436
Echinococcus granulosus receptor type guanylyl cyclase 0.0026 0.0049 0.0049
Echinococcus granulosus cpg binding protein 0.0096 0.0599 0.0599
Onchocerca volvulus 0.0088 0.054 0.0978
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0057 0.0297 0.0297
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0026 0.0049 0.009
Toxoplasma gondii FATC domain-containing protein 0.0027 0.0058 0.0473
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0074 0.0432 0.0432
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0057 0.0297 0.0538
Echinococcus multilocularis carboxylesterase 5A 0.0339 0.2517 0.2517
Loa Loa (eye worm) inositol-1 0.0042 0.0176 0.0321
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Entamoeba histolytica hypothetical protein 0.0026 0.0049 0.2793
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0092 0.0574 0.0574
Echinococcus multilocularis acetylcholinesterase 0.0339 0.2517 0.2517
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0176 0.0318
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0092 0.0574 0.0574
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Trichomonas vaginalis inositol monophosphatase, putative 0.0042 0.0176 0.0318
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0007 0.0012
Loa Loa (eye worm) hypothetical protein 0.0108 0.0694 0.1268
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0023 0.0028 0.0051
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.019 0.1344 0.1344
Echinococcus multilocularis dnaJ subfamily B 0.1288 1 1
Schistosoma mansoni hypothetical protein 0.005 0.0238 0.0238
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0055 0.0282 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0158 0.1087 0.1985
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Echinococcus granulosus geminin 0.0535 0.4065 0.4065
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0176 0.0321
Trypanosoma cruzi serine carboxypeptidase S28, putative 0.002 0.0001 0.0001
Loa Loa (eye worm) glutamate receptor 1 0.0164 0.1141 0.2083
Leishmania major extracellular receptor, putative 0.0026 0.0049 0.009
Loa Loa (eye worm) carboxylesterase 0.0057 0.0297 0.0542
Loa Loa (eye worm) hypothetical protein 0.0088 0.054 0.0987
Onchocerca volvulus 0.0055 0.0277 0.05
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0258 0.1877 0.3429
Echinococcus granulosus nmda type glutamate receptor 0.0179 0.1255 0.1255
Schistosoma mansoni family S28 unassigned peptidase (S28 family) 0.002 0.0001 0.0001
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0087 0.0532 0.0532
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0027 0.0058 0.0106
Echinococcus multilocularis lamin 0.0031 0.0086 0.0086
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0044 0.5
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0176 0.0318
Loa Loa (eye worm) glutamate receptor 0.0026 0.0049 0.009
Loa Loa (eye worm) latrophilin receptor protein 2 0.005 0.0238 0.0435
Trypanosoma cruzi putative prolyl carboxypeptidase, putative 0.002 0.0001 0.0001
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Schistosoma mansoni glutamate receptor NMDA 0.0378 0.2829 0.2829
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.002 0.0007 0.0012
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0042 0.0176 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0044 0.008
Echinococcus granulosus acetylcholinesterase 0.0339 0.2517 0.2517
Echinococcus multilocularis receptor type guanylyl cyclase 0.0026 0.0049 0.0049
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0026 0.0049 0.0049
Loa Loa (eye worm) MH2 domain-containing protein 0.0122 0.081 0.148
Echinococcus granulosus glutamate NMDA receptor subunit 0.0378 0.2829 0.2829
Onchocerca volvulus 0.0026 0.0049 0.0088
Plasmodium vivax SET domain protein, putative 0.0092 0.0574 1
Schistosoma mansoni neuroligin 3 (S09 family) 0.0057 0.0297 0.0297
Echinococcus multilocularis neuropeptide receptor A26 0.0539 0.409 0.409
Brugia malayi Serine carboxypeptidase S28 family protein 0.009 0.0556 0.1016
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0027 0.0058 0.0106
Brugia malayi Pre-SET motif family protein 0.0633 0.4832 0.8826
Loa Loa (eye worm) hypothetical protein 0.0268 0.196 0.358
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.125 0.2266
Echinococcus multilocularis survival motor neuron protein 1 0.0268 0.196 0.196
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.005 0.0238 0.0435
Trichomonas vaginalis Clan SC, family S28, unassigned serine peptidase 0.002 0.0001 0.0001
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0007 0.0012
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.0994 0.0994
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.1179 0.2136
Echinococcus granulosus inositol monophosphatase 1 0.0042 0.0176 0.0176
Trichomonas vaginalis lysosomal pro-X carboxypeptidase, putative 0.002 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0031 0.0086 0.0158
Onchocerca volvulus Atrial natriuretic peptide receptor 3 homolog 0.0026 0.0049 0.0088
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Brugia malayi Carboxylesterase family protein 0.0057 0.0297 0.0542
Echinococcus granulosus serotonin transporter 0.0088 0.054 0.054
Schistosoma mansoni metabotropic glutamate receptor 0.0026 0.0049 0.0049
Echinococcus multilocularis para nitrobenzyl esterase 0.0057 0.0297 0.0297
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0088 0.054 0.054
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0074 0.0432 0.0432
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0044 0.5
Echinococcus multilocularis glutamate receptor NMDA 0.0153 0.1051 0.1051
Trypanosoma brucei C-8 sterol isomerase, putative 0.0714 0.5475 1
Echinococcus multilocularis Lysosomal Pro X carboxypeptidase 0.002 0.0001 0.0001
Loa Loa (eye worm) RGC/RGC protein kinase 0.0026 0.0049 0.009
Echinococcus multilocularis BC026374 protein (S09 family) 0.0057 0.0297 0.0297
Loa Loa (eye worm) histone methyltransferase 0.0031 0.0092 0.0168
Echinococcus multilocularis cpg binding protein 0.0096 0.0599 0.0599
Schistosoma mansoni glutamate receptor kainate 0.0164 0.1141 0.1141
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.002 0 0.0001
Loa Loa (eye worm) hypothetical protein 0.0026 0.0049 0.009
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.005 0.0238 0.0238
Entamoeba histolytica serine carboxypeptidase (S28) family protein 0.002 0.0001 0.0033
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0146 0.0994 0.0994
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0092 0.0574 0.0574
Loa Loa (eye worm) RGC/RGC protein kinase 0.0026 0.0049 0.009
Echinococcus granulosus GPCR family 2 0.005 0.0238 0.0238
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0146 0.0994 0.0994
Schistosoma mansoni lysosomal Pro-Xaa carboxypeptidase (S28 family) 0.009 0.0556 0.0556
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.019 0.1344 0.1344
Onchocerca volvulus 0.0057 0.0297 0.0537
Trichomonas vaginalis glucosylceramidase, putative 0.0258 0.1877 0.3402
Brugia malayi metabotropic glutamate receptor type 2 0.0026 0.0049 0.009
Schistosoma mansoni glutamate receptor AMPA 0.0164 0.1141 0.1141
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0092 0.0574 0.0574

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 14.7157 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) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) 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.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.