Detailed information for compound 1328549

Basic information

Technical information
  • TDR Targets ID: 1328549
  • Name: methyl N-[(2-naphthalen-1-ylacetyl)amino]carb amate
  • MW: 258.273 | Formula: C14H14N2O3
  • H donors: 2 H acceptors: 2 LogP: 2.3 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=O)NNC(=O)Cc1cccc2c1cccc2
  • InChi: 1S/C14H14N2O3/c1-19-14(18)16-15-13(17)9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
  • InChiKey: HONHEYAHVCHWRR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • methyl N-[[2-(1-naphthyl)acetyl]amino]carbamate
  • N-[[2-(1-naphthyl)-1-oxoethyl]amino]carbamic acid methyl ester
  • N-[[2-(1-naphthyl)acetyl]amino]carbamic acid methyl ester
  • methyl N-(2-naphthalen-1-ylethanoylamino)carbamate
  • AN-329/41402854
  • ARONIS003371
  • MLS000701416
  • SMR000228769
  • methyl 2-(1-naphthylacetyl)hydrazinecarboxylate
  • ZINC00142782
  • ST040180

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens ATM serine/threonine kinase Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma brucei phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Candida albicans similar to putative phosphatidylinositol kinase involved in telomere length regulation Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum ko:K04728 ataxia telangectasia mutated family protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma brucei gambiense phosphatidylinositol kinase domain protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania mexicana phosphatidylinositol 3-kinase-like protein Get druggable targets OG5_128955 All targets in OG5_128955
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania braziliensis phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus multilocularis serine protein kinase ATM Get druggable targets OG5_128955 All targets in OG5_128955
Echinococcus granulosus serine protein kinase ATM Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum IPR000971,Globin;IPR012292,Globin-related;IPR009050,Globin-like,domain-containing Get druggable targets OG5_128955 All targets in OG5_128955
Candida albicans similar to putative phosphatidylinositol kinase involved in telomere length regulation Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Schistosoma mansoni ataxia telangiectasia mutated (atm) Get druggable targets OG5_128955 All targets in OG5_128955
Toxoplasma gondii FATC domain-containing protein Get druggable targets OG5_128955 All targets in OG5_128955
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania infantum phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Entamoeba histolytica hypothetical protein Get druggable targets OG5_128955 All targets in OG5_128955
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_128955 All targets in OG5_128955
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania major phosphatidylinositol kinase related protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
Candida albicans identical to the C terminus of CaP19.5580 potential phosphatidylinositol kinase Get druggable targets OG5_128955 All targets in OG5_128955
Leishmania donovani phosphatidylinositol 3-kinase-like protein Get druggable targets OG5_128955 All targets in OG5_128955
Neospora caninum phosphatidylinositol 3- and 4-kinase domain- containing protein, putative Get druggable targets OG5_128955 All targets in OG5_128955
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
Echinococcus granulosus geminin 0.0171 0.5223 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1304 0.117
Loa Loa (eye worm) TAR-binding protein 0.0073 0.198 0.2624
Brugia malayi beta-lactamase 0.0043 0.0987 0.113
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0035 0.0693 0.2458
Toxoplasma gondii pyruvate kinase PyK1 0.0039 0.0827 0.2937
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0987 0.113
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0022 0.0269 0.0847
Trichomonas vaginalis esterase, putative 0.0043 0.0987 0.114
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0827 0.0956
Mycobacterium ulcerans beta-lactamase 0.0043 0.0987 0.6272
Brugia malayi TAR-binding protein 0.0073 0.198 0.2473
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Plasmodium vivax glutathione reductase, putative 0.0099 0.2817 1
Leishmania major trypanothione reductase 0.0099 0.2817 0.8764
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Entamoeba histolytica pyruvate kinase, putative 0.0027 0.0439 0.087
Brugia malayi serine/threonine-protein kinase plk-2 0.011 0.3177 0.4091
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0026 0.04 0.0451
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0034 0.0679 0.1409
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0034 0.0679 0.1896
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0058 0.1467 0.1502
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0987 0.1307
Mycobacterium tuberculosis Conserved protein 0.0043 0.0987 0.0942
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.003 0.054 0.0394
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0827 0.1096
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0099 0.2817 0.3076
Plasmodium falciparum pyruvate kinase 0.0039 0.0827 0.2459
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0034 0.0679 0.1409
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0034 0.0679 0.3883
Schistosoma mansoni kinase 0.0056 0.1391 0.1258
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1467 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Trypanosoma brucei trypanothione reductase 0.0099 0.2817 0.8869
Plasmodium vivax thioredoxin reductase, putative 0.0099 0.2817 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.1304 0.1727
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0987 0.114
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.011 0.3177 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0099 0.2837 0.5295
Toxoplasma gondii hypothetical protein 0.0019 0.0178 0.0633
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0693 0.1067
Brugia malayi beta-lactamase family protein 0.0043 0.0987 0.113
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0022 0.0269 0.0232
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0022 0.0269 0.0847
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.003 0.054 0.1699
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Schistosoma mansoni tar DNA-binding protein 0.0073 0.198 0.1857
Loa Loa (eye worm) hypothetical protein 0.0039 0.0827 0.1096
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.025 0.7842 0.8934
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.0855 0.0952
Toxoplasma gondii NADPH-glutathione reductase 0.0034 0.0679 0.241
Echinococcus granulosus histone lysine methyltransferase setb 0.0035 0.0693 0.1067
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0827 0.0169
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Schistosoma mansoni serine/threonine protein kinase 0.011 0.3177 0.3072
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0269 0.0357
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Onchocerca volvulus Serine\/threonine kinase homolog 0.011 0.3177 0.3121
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0987 0.0848
Mycobacterium tuberculosis Probable reductase 0.0225 0.7009 0.7963
Brugia malayi Pre-SET motif family protein 0.0035 0.0693 0.0732
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Echinococcus multilocularis pyruvate kinase 0.002 0.0203 0.0102
Echinococcus granulosus CAAX prenyl protease 2 0.0093 0.2615 0.4858
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0987 0.2468
Trypanosoma cruzi trypanothione reductase, putative 0.0099 0.2817 0.8764
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0034 0.0679 0.0713
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Brugia malayi RNA binding protein 0.0073 0.198 0.2473
Echinococcus multilocularis pyruvate kinase 0.0039 0.0827 0.1333
Mycobacterium leprae Probable lipase LipE 0.0043 0.0987 0.0227
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0034 0.0679 0.5
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0034 0.0679 0.1409
Mycobacterium tuberculosis Probable dehydrogenase 0.0225 0.7009 0.7963
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0034 0.0679 0.3883
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Trichomonas vaginalis set domain proteins, putative 0.0275 0.8652 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.1462 0.1937
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0987 0.6272
Giardia lamblia Kinase, PLK 0.011 0.3177 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Brugia malayi Pyruvate kinase, M2 isozyme 0.0039 0.0827 0.0914
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0987 0.3063
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0034 0.0679 0.104
Mycobacterium ulcerans hypothetical protein 0.0043 0.0987 0.6272
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1304 0.2272
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.1304 0.2272
Chlamydia trachomatis pyruvate kinase 0.0039 0.0827 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0987 0.114
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0987 0.0942
Onchocerca volvulus 0.0275 0.8652 1
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.1343 0.1552
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0034 0.0679 0.1896
Loa Loa (eye worm) hypothetical protein 0.0058 0.1462 0.1937
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0225 0.7009 0.7963
Brugia malayi Pre-SET motif family protein 0.0241 0.7546 1
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0022 0.0269 0.0232
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0987 0.114
Leishmania major CAAX prenyl protease 2, putative,peptidase with unknown catalytic mechanism (family U48) 0.0093 0.2615 0.8069
Trypanosoma brucei CAAX amino terminal protease, putative 0.0093 0.2615 0.8233
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0987 0.0942
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.025 0.7842 1
Giardia lamblia Pyruvate kinase 0.0039 0.0827 0.2099
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0034 0.0679 0.1896
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0987 0.0942
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0827 0.0956
Giardia lamblia NADH oxidase lateral transfer candidate 0.0034 0.0679 0.16
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1467 0.2594
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0034 0.0679 0.2137
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Loa Loa (eye worm) glutathione reductase 0.0099 0.2817 0.3733
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0022 0.0271 0.0005
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0827 0.0169
Schistosoma mansoni hypothetical protein 0.004 0.0855 0.0715
Echinococcus granulosus pyruvate kinase 0.002 0.0203 0.0102
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.003 0.054 0.093
Loa Loa (eye worm) hypothetical protein 0.004 0.0855 0.1133
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0054 0.1338 0.1773
Echinococcus multilocularis serine protein kinase ATM 0.003 0.054 0.0766
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Schistosoma mansoni pyruvate kinase 0.002 0.0203 0.0053
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0987 0.0227
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0022 0.0269 0.0302
Echinococcus multilocularis CAAX prenyl protease 2 0.0093 0.2615 0.4858
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0827 0.192
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0034 0.0679 0.2137
Loa Loa (eye worm) hypothetical protein 0.0043 0.0987 0.1307
Loa Loa (eye worm) beta-lactamase 0.0043 0.0987 0.1307
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0987 0.1647
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0035 0.0693 0.1067
Mycobacterium ulcerans lipase LipD 0.0043 0.0987 0.6272
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0827 0.192
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0034 0.0679 0.0536
Loa Loa (eye worm) hypothetical protein 0.0026 0.04 0.053
Trypanosoma cruzi trypanothione reductase, putative 0.0034 0.0679 0.1409
Echinococcus multilocularis pyruvate kinase 0.002 0.0203 0.0102
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0225 0.7009 0.8813
Schistosoma mansoni hypothetical protein 0.0171 0.5223 0.5149
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0693 0.055
Schistosoma mansoni tar DNA-binding protein 0.0073 0.198 0.1857
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Trichomonas vaginalis mercuric reductase, putative 0.0034 0.0679 0.0785
Echinococcus granulosus thioredoxin glutathione reductase 0.0099 0.2837 0.5295
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0039 0.0827 0.0757
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.003 0.054 0.0525
Toxoplasma gondii target of rapamycin (TOR), putative 0.0022 0.0269 0.0955
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0058 0.1467 0.412
Leishmania major pyruvate kinase 0.0039 0.0827 0.192
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0225 0.7009 0.7963
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0034 0.0679 0.5
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0151 0.0201
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.065 0.0984
Mycobacterium tuberculosis Probable oxidoreductase 0.025 0.7842 0.8934
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0058 0.1467 0.1336
Giardia lamblia Hypothetical protein 0.0093 0.2615 0.8112
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.1304 0.1558
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.025 0.7842 0.8934
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0987 0.0942
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0025 0.0378 0.0306
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Leishmania major phosphatidylinositol kinase related protein, putative 0.0022 0.0271 0.0005
Echinococcus granulosus serine protein kinase ATM 0.003 0.054 0.0766
Loa Loa (eye worm) pyruvate kinase-PB 0.0027 0.0439 0.0582
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0022 0.0269 0.012
Leishmania major pyruvate kinase 0.0039 0.0827 0.192
Loa Loa (eye worm) thioredoxin reductase 0.0099 0.2817 0.3733
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0269 0.0159
Mycobacterium tuberculosis Conserved protein 0.0043 0.0987 0.0942
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0058 0.1467 0.1779
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0987 0.6272
Echinococcus granulosus serine:threonine protein kinase PLK1 0.011 0.3177 0.5965
Echinococcus granulosus pyruvate kinase 0.002 0.0203 0.0102
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0034 0.0679 0.1896
Onchocerca volvulus 0.0043 0.0987 0.037
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0034 0.0679 0.2137
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0987 0.2468
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1467 0.2594
Trypanosoma cruzi CAAX prenyl protease 2, putative 0.0093 0.2615 0.8069
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0022 0.0269 0.0847
Giardia lamblia GTOR 0.0022 0.0269 0.0222
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.1462 0.1772
Plasmodium vivax pyruvate kinase, putative 0.0039 0.0827 0.2459
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0022 0.0269 0.0847
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1304 0.2272
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0093 0.2615 0.2502
Schistosoma mansoni pyruvate kinase 0.0039 0.0827 0.0686
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.1304 0.2272
Brugia malayi beta-lactamase family protein 0.0043 0.0987 0.113
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0987 0.0848
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0022 0.0269 0.0232
Plasmodium falciparum thioredoxin reductase 0.0099 0.2817 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Toxoplasma gondii pyruvate kinase PyKII 0.002 0.0203 0.0721
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0225 0.7009 0.7963
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0073 0.198 0.2624
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0987 0.3106
Plasmodium vivax SET domain protein, putative 0.0035 0.0693 0.1948
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0241 0.7546 1
Schistosoma mansoni tar DNA-binding protein 0.0073 0.198 0.1857
Schistosoma mansoni pyruvate kinase 0.0039 0.0827 0.0686
Plasmodium falciparum pyruvate kinase 2 0.002 0.0203 0.0094
Entamoeba histolytica serine/threonine protein kinase, putative 0.011 0.3177 1
Echinococcus granulosus tar DNA binding protein 0.0073 0.198 0.3607
Trypanosoma brucei pyruvate kinase 1, putative 0.0039 0.0827 0.2605
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.3177 1
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0022 0.0269 0.0302
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1304 0.117
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0827 0.1096
Brugia malayi CAAX amino terminal protease family protein 0.0093 0.2615 0.3332
Trichomonas vaginalis glutathione reductase, putative 0.0034 0.0679 0.0785
Brugia malayi glutathione reductase 0.0099 0.2817 0.3605
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0022 0.0269 0.012
Toxoplasma gondii FATC domain-containing protein 0.003 0.054 0.1915
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Plasmodium falciparum glutathione reductase 0.0034 0.0679 0.1896
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0034 0.0679 0.7711
Schistosoma mansoni family U48 unassigned peptidase (U48 family) 0.0093 0.2615 0.2502
Brugia malayi Pyruvate kinase, muscle isozyme 0.0039 0.0827 0.0914
Toxoplasma gondii CAAX amino terminal protease family protein 0.0019 0.0178 0.0633
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0987 0.0942
Toxoplasma gondii thioredoxin reductase 0.0099 0.2817 1
Trypanosoma brucei pyruvate kinase 1 0.0039 0.0827 0.2605
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0034 0.0679 0.241
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0987 0.114
Plasmodium vivax pyruvate kinase 2, putative 0.002 0.0203 0.0094
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.011 0.3177 0.4209
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Entamoeba histolytica CAAX prenyl protease family 0.0093 0.2615 0.8128
Loa Loa (eye worm) hypothetical protein 0.0035 0.0693 0.0918
Trichomonas vaginalis PIKK family atypical protein kinase 0.003 0.054 0.0624
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1467 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0987 0.0942
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.3177 1
Toxoplasma gondii hypothetical protein 0.0019 0.0178 0.0633
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.1304 0.117
Echinococcus granulosus pyruvate kinase 0.0039 0.0827 0.1333
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0827 0.1096
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0034 0.0679 0.1409
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0022 0.0269 0.0847
Onchocerca volvulus 0.0043 0.0987 0.037
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0034 0.0679 0.104
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.8756 1
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0034 0.0679 0.2137
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0987 0.0942
Loa Loa (eye worm) phosphatidylinositol 3 0.0022 0.0269 0.0357
Loa Loa (eye worm) hypothetical protein 0.0093 0.2615 0.3465
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Trypanosoma brucei polo-like protein kinase 0.011 0.3177 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0022 0.0269 0.0232
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0693 0.055
Treponema pallidum NADH oxidase 0.0034 0.0679 1
Echinococcus multilocularis pyruvate kinase 0.0039 0.0827 0.1333
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.1462 0.1772
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0693 0.055
Echinococcus multilocularis pyruvate kinase 0.002 0.0203 0.0102
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0987 0.1647
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0034 0.0679 0.1409
Mycobacterium tuberculosis Conserved protein 0.0043 0.0987 0.0942
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0022 0.0269 0.0159
Entamoeba histolytica hypothetical protein 0.003 0.054 0.1205
Echinococcus multilocularis geminin 0.0171 0.5223 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Echinococcus multilocularis pyruvate kinase 0.0031 0.0557 0.08
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0025 0.0378 0.0306
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0034 0.0679 0.3883
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0225 0.7009 0.7963
Plasmodium falciparum glutathione reductase 0.0099 0.2817 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0987 0.114
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0034 0.0679 0.0583
Onchocerca volvulus 0.0043 0.0987 0.037
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Leishmania major hypothetical protein, conserved 0.0043 0.0987 0.2468
Schistosoma mansoni tar DNA-binding protein 0.0073 0.198 0.1857
Mycobacterium ulcerans pyruvate kinase 0.0039 0.0827 0.5036
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.011 0.3177 0.5965
Trypanosoma cruzi peptidase with unknown catalytic mechanism (family U48) 0.0093 0.2615 0.8069
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0827 0.0169
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Plasmodium falciparum thioredoxin reductase 0.0034 0.0679 0.1896
Echinococcus granulosus pyruvate kinase 0.002 0.0203 0.0102
Toxoplasma gondii ABC1 family protein 0.0043 0.0987 0.3502
Echinococcus multilocularis tar DNA binding protein 0.0073 0.198 0.3607
Schistosoma mansoni hypothetical protein 0.0171 0.5223 0.5149
Echinococcus granulosus pyruvate kinase 0.0039 0.0827 0.1333
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0693 0.055
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Loa Loa (eye worm) RNA binding protein 0.0073 0.198 0.2624
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Brugia malayi RNA recognition motif domain containing protein 0.0073 0.198 0.2473
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.1343 0.1552
Schistosoma mansoni tar DNA-binding protein 0.0073 0.198 0.1857
Trichomonas vaginalis CAMK family protein kinase 0.011 0.3177 0.3671
Trichomonas vaginalis Clan U, family U48, CaaX prenyl peptidase 2-like 0.0093 0.2615 0.3023
Brugia malayi Thioredoxin reductase 0.0099 0.2817 0.3605
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311
Loa Loa (eye worm) hypothetical protein 0.0018 0.0151 0.0201
Loa Loa (eye worm) hypothetical protein 0.0027 0.0439 0.0582
Trichomonas vaginalis PIKK family atypical protein kinase 0.0022 0.0269 0.0311

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 1.7783 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying a Potential Treatment of Ataxia-Telangiectasia. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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