Detailed information for compound 1416081

Basic information

Technical information
  • TDR Targets ID: 1416081
  • Name: N-(oxolan-2-ylmethyl)-2-pyridin-4-ylquinoline -4-carboxamide
  • MW: 333.384 | Formula: C20H19N3O2
  • H donors: 1 H acceptors: 3 LogP: 2.47 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1cc(nc2c1cccc2)c1ccncc1)NCC1CCCO1
  • InChi: 1S/C20H19N3O2/c24-20(22-13-15-4-3-11-25-15)17-12-19(14-7-9-21-10-8-14)23-18-6-2-1-5-16(17)18/h1-2,5-10,12,15H,3-4,11,13H2,(H,22,24)
  • InChiKey: UPYVSHQVIJPUAD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(4-pyridyl)-N-(tetrahydrofuran-2-ylmethyl)quinoline-4-carboxamide
  • 2-(4-pyridyl)-N-(2-tetrahydrofuranylmethyl)-4-quinolinecarboxamide
  • 2-(4-pyridyl)-N-(tetrahydrofurfuryl)cinchoninamide
  • N-(oxolan-2-ylmethyl)-2-pyridin-4-yl-quinoline-4-carboxamide
  • EU-0097115

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
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0036 0.0063
Onchocerca volvulus 0.0035 0.0182 0.0283
Trypanosoma brucei hypothetical protein, conserved 0.0079 0.0595 0.4211
Entamoeba histolytica hypothetical protein 0.0144 0.1226 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0502 0.4652 1
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0044 0.0122
Loa Loa (eye worm) hypothetical protein 0.0021 0.0044 0.0038
Brugia malayi Hhat protein 0.0021 0.0044 0.0016
Echinococcus multilocularis geminin 0.0164 0.1413 0.1413
Trichomonas vaginalis transmembrane protein nessy, putative 0.0021 0.0044 0.0039
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0492 0.1103
Brugia malayi Bromodomain containing protein 0.0073 0.0537 0.0511
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0036 0.0008
Schistosoma mansoni hypothetical protein 0.0035 0.0181 0.0181
Plasmodium vivax hypothetical protein, conserved 0.0022 0.0052 0.024
Loa Loa (eye worm) hypothetical protein 0.0039 0.022 0.0214
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0021 0.0044 0.0038
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0021 0.0044 0.0044
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0234 0.039
Leishmania major glycerol uptake protein, putative 0.0021 0.0044 0.0122
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Leishmania major glycerol uptake protein, putative 0.0021 0.0044 0.0122
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0595 0.4211
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0051 0.0051
Brugia malayi methionyl-tRNA synthetase 0.0022 0.0052 0.0024
Onchocerca volvulus 0.0069 0.0503 0.094
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0285 0.2574 0.2574
Mycobacterium leprae Probable lipase LipE 0.0079 0.0595 0.2512
Echinococcus granulosus chromobox protein 1 0.0068 0.0492 0.0492
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0051 0.0051
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0079 0.0382
Brugia malayi PHD-finger family protein 0.0024 0.0073 0.0046
Plasmodium vivax SET domain protein, putative 0.0058 0.0397 0.3633
Brugia malayi Bromodomain containing protein 0.0037 0.0197 0.017
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0021 0.0044 0.0044
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) 0.0057 0.0392 0.0788
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.106 1 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0142 0.12 0.2535
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0234 0.049
Onchocerca volvulus 0.0079 0.0595 0.1128
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0314 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0069 0.0503 0.0503
Loa Loa (eye worm) hypothetical protein 0.0104 0.0842 0.0836
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0144 0.1226 0.1226
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0175 0.0175
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0314 0.0288
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0056 0.0377 0.0757
Trypanosoma cruzi hypothetical protein, conserved 0.0079 0.0595 0.4211
Trypanosoma cruzi trypanothione reductase, putative 0.0056 0.0377 0.2597
Treponema pallidum alginate O-acetylation protein (algI) 0.0021 0.0044 0.6729
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0044 0.0122
Leishmania major hypothetical protein, conserved 0.0025 0.0079 0.0382
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0044 0.0067
Schistosoma mansoni hypothetical protein 0.0144 0.1226 0.1226
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0035 0.0181 0.0181
Trichomonas vaginalis chromobox protein, putative 0.0068 0.0492 0.1103
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0285 0.2574 0.2574
Loa Loa (eye worm) beta-lactamase 0.0079 0.0595 0.0589
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.016 0.1375 1
Schistosoma mansoni ap endonuclease 0.002 0.0036 0.0036
Brugia malayi chromobox protein homolog 3 0.0038 0.0206 0.018
Plasmodium vivax hypothetical protein, conserved 0.0079 0.0595 0.5584
Plasmodium falciparum glutathione reductase 0.0056 0.0377 0.3444
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0285 0.2574 0.257
Onchocerca volvulus 0.0459 0.4244 0.8596
Mycobacterium tuberculosis Conserved protein 0.0079 0.0595 0.1227
Toxoplasma gondii ABC1 family protein 0.0079 0.0595 0.4211
Brugia malayi beta-lactamase family protein 0.0079 0.0595 0.0569
Leishmania major trypanothione reductase 0.0056 0.0377 0.2597
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0144 0.1226 0.1226
Loa Loa (eye worm) heterochromatin protein 1 0.0068 0.0492 0.0487
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Chlamydia trachomatis leucine--tRNA ligase 0.0022 0.0052 1
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Mycobacterium tuberculosis Probable lipase LipD 0.0079 0.0595 0.1227
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0044 0.0044
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0058 0.0397 0.0397
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0036 0.0083
Loa Loa (eye worm) hypothetical protein 0.0025 0.0079 0.0073
Leishmania major diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Loa Loa (eye worm) hypothetical protein 0.0022 0.0052 0.0046
Plasmodium vivax methionine--tRNA ligase, putative 0.0022 0.0052 0.024
Loa Loa (eye worm) hypothetical protein 0.0049 0.0314 0.0309
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0035 0.0181 0.0181
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0125 0.1044 0.7542
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0285 0.2574 0.2574
Toxoplasma gondii thioredoxin reductase 0.0056 0.0377 0.2597
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0051 0.0051
Leishmania major methionyl-tRNA synthetase, putative 0.0057 0.0392 0.2705
Echinococcus granulosus thioredoxin glutathione reductase 0.0056 0.0377 0.0377
Echinococcus granulosus zinc finger protein 0.0019 0.0023 0.0023
Loa Loa (eye worm) glutathione reductase 0.0056 0.0377 0.0372
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0595 0.0595
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0079 0.0382
Brugia malayi beta-lactamase 0.0079 0.0595 0.0569
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0595 0.1346
Loa Loa (eye worm) hypothetical protein 0.0068 0.0498 0.0492
Schistosoma mansoni ap endonuclease 0.002 0.0036 0.0036
Brugia malayi diacylglycerol acyltransferase 0.0125 0.1044 0.1019
Giardia lamblia Methionyl-tRNA synthetase 0.0057 0.0392 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0044 0.0038
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0044 0.0067
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0234 0.049
Mycobacterium tuberculosis Probable reductase 0.0127 0.1063 0.224
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0127 0.1063 0.224
Treponema pallidum methionyl-tRNA synthetase 0.0022 0.0052 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0285 0.2574 0.2574
Mycobacterium ulcerans esterase/lipase LipP 0.0079 0.0595 1
Brugia malayi beta-lactamase family protein 0.0079 0.0595 0.0569
Entamoeba histolytica hypothetical protein 0.0144 0.1226 1
Leishmania major leucyl-tRNA synthetase, putative 0.0022 0.0052 0.0181
Echinococcus multilocularis chromobox protein 1 0.0068 0.0492 0.0492
Echinococcus multilocularis zinc finger transcription factor gli2 0.0333 0.3032 0.3032
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0021 0.0044 0.0044
Mycobacterium tuberculosis Probable esterase LipL 0.0079 0.0595 0.1227
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0079 0.0507
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0044 0.0122
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0036 0.0231
Onchocerca volvulus 0.0531 0.493 1
Brugia malayi Zinc finger, C2H2 type family protein 0.0333 0.3032 0.3013
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0079 0.0507
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0056 0.0376 0.0376
Schistosoma mansoni zinc finger protein 0.0021 0.0044 0.0044
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0165 0.0138
Loa Loa (eye worm) thioredoxin reductase 0.0056 0.0377 0.0372
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0036 0.002
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0044 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0021 0.0044 0.0044
Entamoeba histolytica vacuolar protein sorting 26 0.0021 0.0044 0.0067
Giardia lamblia Leucyl-tRNA synthetase 0.0022 0.0052 0.0669
Loa Loa (eye worm) hypothetical protein 0.106 1 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0142 0.12 0.2535
Loa Loa (eye worm) hypothetical protein 0.0037 0.0198 0.0192
Toxoplasma gondii hypothetical protein 0.0043 0.0249 0.1648
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Loa Loa (eye worm) tyrosyl-tRNA synthetase 0.0035 0.0182 0.0176
Echinococcus multilocularis beta LACTamase domain containing family member 0.0079 0.0595 0.0595
Brugia malayi MBOAT family protein 0.0021 0.0044 0.0016
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0125 0.1044 0.7542
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0074 0.0555 0.0555
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Mycobacterium tuberculosis Probable hydrolase 0.0079 0.0595 0.1227
Brugia malayi Pre-SET motif family protein 0.0058 0.0397 0.037
Echinococcus granulosus beta LACTamase domain containing family member 0.0079 0.0595 0.0595
Brugia malayi MBOAT family protein 0.0021 0.0044 0.0016
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0044 0.0038
Entamoeba histolytica hypothetical protein 0.0144 0.1226 1
Brugia malayi diacylglycerol acyltransferase family protein 0.016 0.1375 0.1351
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0404 0.3709 0.3706
Toxoplasma gondii mono- or diacylglycerol acyltransferase 0.0035 0.0181 0.1143
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0125 0.1044 0.1038
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0044 0.0044
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.01 0.0172
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0142 0.12 1
Onchocerca volvulus 0.016 0.1375 0.2724
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0044 0.0044
Trypanosoma brucei glycerol uptake protein, putative 0.0021 0.0044 0.0122
Leishmania major glycerol uptake protein, putative 0.0021 0.0044 0.0122
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0044 0.0044
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0125 0.1044 0.1044
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0033 0.0028
Loa Loa (eye worm) diacylglycerol acyltransferase 0.016 0.1375 0.137
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.106 1 1
Echinococcus multilocularis sterol O acyltransferase 1 0.0021 0.0044 0.0044
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0036 0.0231
Leishmania major hypothetical protein, conserved 0.0079 0.0595 0.4211
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0079 0.0595 0.1227
Leishmania major glycerol uptake protein, putative 0.0021 0.0044 0.0122
Schistosoma mansoni hypothetical protein 0.0034 0.0165 0.0165
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0175 0.0175
Loa Loa (eye worm) hypothetical protein 0.0021 0.0044 0.0038
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0036 0.003
Toxoplasma gondii diacylglycerol acyltransferase 0.0035 0.0181 0.1143
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0019 0.0027 0.0027
Entamoeba histolytica methionyl-tRNA synthetase, putative 0.0022 0.0052 0.0134
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0036 0.0148
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase 0.0057 0.0392 1
Plasmodium falciparum thioredoxin reductase 0.0056 0.0377 0.3444
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0036 0.3454
Toxoplasma gondii hypothetical protein 0.0021 0.0044 0.0122
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0021 0.0044 0.0044
Schistosoma mansoni transcription factor LCR-F1 0.0144 0.1226 0.1226
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0036 0.0063
Schistosoma mansoni hypothetical protein 0.0021 0.0044 0.0044
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0019 0.0027 0.0027
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0125 0.1044 0.1044
Brugia malayi protein ZK524.3 0.0022 0.0052 0.0024
Entamoeba histolytica hypothetical protein, conserved 0.0021 0.0044 0.0067
Mycobacterium ulcerans lipase LipD 0.0079 0.0595 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0285 0.2574 0.2574
Trypanosoma cruzi GUP1, putative 0.0021 0.0044 0.0122
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0285 0.2574 0.2554
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0125 0.1044 1
Brugia malayi Thioredoxin reductase 0.0056 0.0377 0.0351
Echinococcus granulosus chromobox protein 1 0.0068 0.0492 0.0492
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0285 0.2574 0.2574
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Leishmania major diacylglycerol acyltransferase, putative 0.016 0.1375 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0595 0.1346
Trichomonas vaginalis porcupine, putative 0.0021 0.0044 0.0039
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0019 0.0027 0.0027
Mycobacterium tuberculosis Probable dehydrogenase 0.0127 0.1063 0.224
Trypanosoma cruzi methionyl-tRNA synthetase, putative 0.0057 0.0392 0.2705
Leishmania major hypothetical protein, conserved 0.0021 0.0044 0.0122
Trichomonas vaginalis set domain proteins, putative 0.0459 0.4244 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0036 0.0036
Schistosoma mansoni chromobox protein 0.0068 0.0492 0.0492
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0036 0.0063
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0074 0.0555 0.0555
Onchocerca volvulus 0.003 0.0128 0.0172
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0021 0.0044 0.0044
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0036 0.0036
Brugia malayi Pax transcription factor protein 2 0.0531 0.493 0.4916
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.106 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0165 0.0159
Trypanosoma cruzi GUP1, putative 0.0021 0.0044 0.0122
Leishmania major diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0206 0.0425
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0044 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Schistosoma mansoni zinc finger protein 0.0019 0.0023 0.0023
Schistosoma mansoni bromodomain containing protein 0.0061 0.0429 0.0429
Echinococcus granulosus methionyl tRNA synthetase cytoplasmic 0.0022 0.0052 0.0052
Loa Loa (eye worm) hypothetical protein 0.003 0.0128 0.0122
Mycobacterium tuberculosis Conserved protein 0.0079 0.0595 0.1227
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0058 0.0396 0.0396
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0035 0.0181 0.1143
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0057 0.0392 0.0386
Brugia malayi Heterochromatin protein 1 0.0068 0.0492 0.0466
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.016 0.1375 1
Brugia malayi hypothetical protein 0.0144 0.1226 0.1202
Echinococcus multilocularis leucyl tRNA synthetase 0.0022 0.0052 0.0052
Brugia malayi MBOAT family protein 0.0021 0.0044 0.0016
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0127 0.1063 0.224
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0044 0.0038
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0058 0.0396 0.0396
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0142 0.12 0.2535
Mycobacterium ulcerans leucyl-tRNA synthetase 0.0022 0.0052 0.043
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0021 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0164 0.1413 0.1413
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0021 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0164 0.1413 0.1413
Loa Loa (eye worm) hypothetical protein 0.0021 0.0044 0.0038
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0125 0.1044 0.1044
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0058 0.0397 0.0397
Schistosoma mansoni chromobox protein 0.0068 0.0492 0.0492
Mycobacterium leprae conserved hypothetical protein 0.0079 0.0595 0.2512
Leishmania major hypothetical protein, unknown function,protein, unknown function 0.0035 0.0181 0.1143
Toxoplasma gondii tRNA ligases class I (M) protein 0.0022 0.0052 0.0181
Echinococcus multilocularis methionine tRNA synthetase 0.0057 0.0392 0.0392
Loa Loa (eye worm) zinc finger protein 0.0333 0.3032 0.3028
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0074 0.0555 0.0555
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0021 0.0044 0.0044
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0079 0.0595 0.0569
Brugia malayi MBOAT family protein 0.0021 0.0044 0.0016
Plasmodium falciparum methionine--tRNA ligase, putative 0.0022 0.0052 0.024
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0314 0.0288
Trichomonas vaginalis esterase, putative 0.0079 0.0595 0.1346
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0206 0.0425
Brugia malayi MBOAT family protein 0.0021 0.0044 0.0016
Mycobacterium ulcerans methionyl-tRNA synthetase 0.0057 0.0392 0.6424
Schistosoma mansoni leucyl-tRNA synthetase 0.0022 0.0052 0.0052
Chlamydia trachomatis methionine--tRNA ligase 0.0022 0.0052 1
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0036 0.002
Wolbachia endosymbiont of Brugia malayi leucyl-tRNA synthetase 0.0022 0.0052 0.0669
Echinococcus multilocularis thioredoxin glutathione reductase 0.0056 0.0377 0.0377
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0079 0.0595 0.0595
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0044 0.0044
Trypanosoma brucei trypanothione reductase 0.0056 0.0377 0.2597
Plasmodium vivax thioredoxin reductase, putative 0.0056 0.0377 0.3444
Brugia malayi methionyl-tRNA synthetase 0.0057 0.0392 0.0365
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0079 0.0507
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0079 0.0382
Trichomonas vaginalis conserved hypothetical protein 0.0021 0.0044 0.0039
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0206 0.0333
Trypanosoma cruzi glycerol uptake protein, putative 0.0021 0.0044 0.0122
Trichomonas vaginalis penicillin-binding protein, putative 0.0079 0.0595 0.1346
Entamoeba histolytica hypothetical protein 0.0021 0.0044 0.0067
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0079 0.0382
Echinococcus granulosus sterol O acyltransferase 1 0.0021 0.0044 0.0044
Onchocerca volvulus 0.0079 0.0595 0.1128
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0044 0.0044
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0079 0.0595 0.1227
Entamoeba histolytica hypothetical protein 0.0144 0.1226 1
Brugia malayi glutathione reductase 0.0056 0.0377 0.0351
Loa Loa (eye worm) hypothetical protein 0.0022 0.0052 0.0046
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0058 0.0397 0.274
Mycobacterium tuberculosis Conserved protein 0.0079 0.0595 0.1227
Schistosoma mansoni sterol O-acyltransferase 1 0.0021 0.0044 0.0044
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0127 0.1063 0.224
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0079 0.0595 0.0589
Loa Loa (eye worm) hhat protein 0.0021 0.0044 0.0038
Echinococcus multilocularis methionyl tRNA synthetase, cytoplasmic 0.0022 0.0052 0.0052
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Toxoplasma gondii exonuclease III APE 0.002 0.0036 0.0063
Mycobacterium ulcerans hypothetical protein 0.0079 0.0595 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0036 0.0083
Toxoplasma gondii dgat2l1-prov protein 0.016 0.1375 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0127 0.1063 0.224
Brugia malayi Pre-SET motif family protein 0.0404 0.3709 0.3692
Leishmania major glycerol uptake protein, putative 0.0021 0.0044 0.0122
Loa Loa (eye worm) hypothetical protein 0.0079 0.0595 0.0589
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0021 0.0044 0.0044
Mycobacterium ulcerans beta-lactamase 0.0079 0.0595 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0285 0.2574 0.2574
Loa Loa (eye worm) hypothetical protein 0.0074 0.0555 0.0549
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0021 0.0044 0.0044
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.01 0.0172
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0595 0.1346
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.016 0.1375 0.1375
Onchocerca volvulus 0.0079 0.0595 0.1128
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0886 0.2037
Echinococcus granulosus o acyltransferase membrane bound domain 0.0021 0.0044 0.0044
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0079 0.0595 0.1227
Loa Loa (eye worm) hypothetical protein 0.0038 0.0206 0.0201
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0036 0.0063
Plasmodium vivax methionine--tRNA ligase, putative 0.0057 0.0392 0.3587
Echinococcus granulosus histone lysine methyltransferase setb 0.0074 0.0555 0.0555
Trypanosoma brucei methionyl-tRNA synthetase, putative 0.0057 0.0392 0.2705
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0021 0.0044 0.0067
Plasmodium falciparum methionine--tRNA ligase 0.0057 0.0392 0.3587
Schistosoma mansoni methionine-tRNA synthetase 0.0057 0.0392 0.0392
Echinococcus granulosus geminin 0.0164 0.1413 0.1413
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0057 0.0392 0.0864
Echinococcus multilocularis zinc finger protein 0.0019 0.0023 0.0023
Loa Loa (eye worm) hhat protein 0.0021 0.0044 0.0038
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0479 0.107
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0127 0.1063 0.8313
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0079 0.0595 1
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0125 0.1044 1
Mycobacterium ulcerans hypothetical protein 0.0035 0.0181 0.2715
Loa Loa (eye worm) MBOAT family protein 0.0021 0.0044 0.0038
Loa Loa (eye worm) hypothetical protein 0.0022 0.0052 0.0046
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0021 0.0044 0.0044
Echinococcus granulosus zinc finger transcription factor gli2 0.0333 0.3032 0.3032
Echinococcus multilocularis chromobox protein 1 0.0068 0.0492 0.0492
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.016 0.1375 1
Echinococcus granulosus methionine tRNA synthetase 0.0057 0.0392 0.0392
Toxoplasma gondii methionyl-tRNA synthetase 0.0057 0.0392 0.2705
Brugia malayi hypothetical protein 0.0025 0.0079 0.0052
Loa Loa (eye worm) hypothetical protein 0.0041 0.0237 0.0232
Treponema pallidum leucyl-tRNA synthetase 0.0022 0.0052 1
Schistosoma mansoni methionine-tRNA synthetase 0.0022 0.0052 0.0052
Trichomonas vaginalis D-aminoacylase, putative 0.0079 0.0595 0.1346
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0036 0.0018
Plasmodium vivax glutathione reductase, putative 0.0056 0.0377 0.3444
Mycobacterium tuberculosis Probable lipase LipE 0.0079 0.0595 0.1227
Schistosoma mansoni hypothetical protein 0.002 0.0033 0.0033
Loa Loa (eye worm) pax transcription factor protein 2 0.0531 0.493 0.4927

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 16.5113 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) = 100 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

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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