Detailed information for compound 1759120

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 404.437 | Formula: C23H21FN4O2
  • H donors: 1 H acceptors: 3 LogP: 3.06 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc2c(c1)c(=O)n(n2Cc1ccc(cc1)F)C)CCc1cccnc1
  • InChi: 1S/C23H21FN4O2/c1-27-23(30)20-13-19(26-22(29)11-6-16-3-2-12-25-14-16)9-10-21(20)28(27)15-17-4-7-18(24)8-5-17/h2-5,7-10,12-14H,6,11,15H2,1H3,(H,26,29)
  • InChiKey: BSMIYSBGQJFHOF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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 BC026374 protein (S09 family) 0.0073 0.0636 0.1434
Echinococcus granulosus para nitrobenzyl esterase 0.0073 0.0636 0.1016
Mycobacterium leprae conserved hypothetical protein 0.0149 0.1416 1
Loa Loa (eye worm) pyruvate kinase 0.0026 0.015 0.0154
Loa Loa (eye worm) hypothetical protein 0.0033 0.0215 0.0236
Trypanosoma brucei PAB1-binding protein , putative 0.0022 0.0107 0.0676
Mycobacterium ulcerans aldehyde dehydrogenase 0.0049 0.0387 0.1054
Trichomonas vaginalis penicillin-binding protein, putative 0.0149 0.1416 1
Schistosoma mansoni hypothetical protein 0.0065 0.0546 0.1227
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0049 0.0387 0.0248
Brugia malayi Carboxylesterase family protein 0.0435 0.4364 0.4349
Loa Loa (eye worm) hypothetical protein 0.0415 0.4164 0.5283
Echinococcus granulosus carboxylesterase 5A 0.0435 0.4364 0.6971
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0149 0.1416 0.1325
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0029 0.018 0.1195
Loa Loa (eye worm) hypothetical protein 0.0022 0.0107 0.0099
Schistosoma mansoni hypothetical protein 0.0065 0.0546 0.1227
Toxoplasma gondii ABC1 family protein 0.0149 0.1416 1
Brugia malayi MH2 domain containing protein 0.0101 0.0924 0.0901
Echinococcus multilocularis peregrin 0.0024 0.0129 0.0209
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0059 0.0487 0.0786
Loa Loa (eye worm) hypothetical protein 0.0435 0.4364 0.5539
Brugia malayi PHD-finger family protein 0.0024 0.0125 0.0099
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Trichomonas vaginalis esterase, putative 0.0149 0.1416 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0235 0.0263
Echinococcus multilocularis lysine specific demethylase 5A 0.0027 0.0157 0.0253
Schistosoma mansoni hypothetical protein 0.014 0.1322 0.3009
Plasmodium vivax hypothetical protein, conserved 0.0022 0.0109 0.0648
Echinococcus granulosus GPCR family 2 0.0065 0.0546 0.0873
Echinococcus granulosus pyruvate kinase 0.0014 0.0018 0.0029
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0029 0.018 0.1195
Toxoplasma gondii histone lysine methyltransferase SET1 0.0092 0.0827 0.5785
Mycobacterium ulcerans aldehyde dehydrogenase 0.0049 0.0387 0.1054
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0205 0.199 0.1969
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0153 0.1462 0.183
Schistosoma mansoni tar DNA-binding protein 0.0051 0.0405 0.0901
Echinococcus multilocularis tar DNA binding protein 0.0051 0.0405 0.0653
Trypanosoma cruzi pyruvate kinase 2, putative 0.0026 0.015 0.0983
Toxoplasma gondii pyruvate kinase PyK1 0.0026 0.015 0.0947
Entamoeba histolytica hypothetical protein 0.0059 0.0487 1
Onchocerca volvulus Pyruvate kinase homolog 0.0026 0.015 0.032
Loa Loa (eye worm) hypothetical protein 0.0016 0.0038 0.0011
Leishmania major pyruvate kinase 0.0026 0.015 0.0983
Echinococcus granulosus cpg binding protein 0.0052 0.0413 0.0659
Trichomonas vaginalis D-aminoacylase, putative 0.0149 0.1416 1
Brugia malayi Latrophilin receptor protein 2 0.0065 0.0546 0.0522
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0016 0.0038 0.0062
Echinococcus multilocularis jumonji domain containing protein 0.0031 0.0199 0.0321
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0153 0.1462 0.3331
Trichomonas vaginalis ap endonuclease, putative 0.0029 0.018 0.0236
Echinococcus multilocularis pyruvate kinase 0.0021 0.0093 0.015
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0073 0.0632 0.1021
Echinococcus multilocularis pyruvate kinase 0.0014 0.0018 0.0029
Onchocerca volvulus 0.0073 0.0636 0.4036
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0029 0.018 0.2677
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.0109 0.0101
Plasmodium falciparum ataxin-2 like protein, putative 0.0022 0.0107 0.5503
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0029 0.018 0.0133
Echinococcus multilocularis muscleblind protein 0.0129 0.1207 0.1949
Brugia malayi latrophilin 2 splice variant baaae 0.014 0.1322 0.1299
Echinococcus multilocularis zinc finger protein 0.0019 0.0078 0.0126
Echinococcus multilocularis beta LACTamase domain containing family member 0.0149 0.1416 0.2287
Brugia malayi beta-lactamase 0.0149 0.1416 0.1394
Loa Loa (eye worm) CXXC zinc finger family protein 0.0047 0.0368 0.0432
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Schistosoma mansoni ap endonuclease 0.0029 0.018 0.0386
Schistosoma mansoni neuroligin 3 (S09 family) 0.0073 0.0636 0.1434
Brugia malayi hypothetical protein 0.0073 0.0636 0.0612
Mycobacterium ulcerans carboxylesterase, LipT 0.0073 0.0636 0.216
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0049 0.0387 0.2672
Trichomonas vaginalis ap endonuclease, putative 0.0029 0.018 0.0236
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0016 0.0038 0.006
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0022 0.0104 0.021
Schistosoma mansoni cellular tumor antigen P53 0.0042 0.0312 0.0688
Schistosoma mansoni methyl-cpg binding protein mbd 0.0014 0.0028 0.0035
Schistosoma mansoni ap endonuclease 0.0029 0.018 0.0386
Onchocerca volvulus Pyruvate kinase homolog 0.0026 0.015 0.032
Schistosoma mansoni pyruvate kinase 0.0026 0.015 0.0317
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0065 0.0546 0.0882
Loa Loa (eye worm) hypothetical protein 0.0207 0.2018 0.2541
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0029 0.018 0.0291
Plasmodium vivax ataxin-2 like protein, putative 0.0022 0.0107 0.0638
Giardia lamblia PHD finger protein 15 0.0022 0.0109 0.5585
Echinococcus granulosus pyruvate kinase 0.0014 0.0018 0.0029
Mycobacterium tuberculosis Conserved protein 0.0149 0.1416 0.1325
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0149 0.1416 0.5625
Brugia malayi jmjC domain containing protein 0.0073 0.0632 0.0608
Schistosoma mansoni aldehyde dehydrogenase 0.0049 0.0387 0.0862
Echinococcus multilocularis carboxylesterase 5A 0.0435 0.4364 0.7047
Loa Loa (eye worm) carboxylesterase 0.0073 0.0636 0.0775
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0022 0.0109 0.0221
Mycobacterium tuberculosis Carboxylesterase LipT 0.0073 0.0636 0.0509
Mycobacterium tuberculosis Probable oxidoreductase 0.0244 0.24 0.2355
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0137 0.1289 0.1192
Onchocerca volvulus 0.0047 0.0368 0.1984
Brugia malayi jmjC domain containing protein 0.0031 0.0202 0.0176
Loa Loa (eye worm) hypothetical protein 0.0773 0.7854 1
Mycobacterium leprae Probable lipase LipE 0.0149 0.1416 1
Mycobacterium ulcerans beta-lactamase 0.0149 0.1416 0.5625
Echinococcus multilocularis PHD finger protein rhinoceros 0.0022 0.0109 0.0175
Echinococcus granulosus acetylcholinesterase 0.0435 0.4364 0.6971
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0029 0.018 0.1195
Schistosoma mansoni gliotactin 0.0073 0.0636 0.1434
Toxoplasma gondii aldehyde dehydrogenase 0.0049 0.0387 0.2643
Schistosoma mansoni tar DNA-binding protein 0.0051 0.0405 0.0901
Trypanosoma cruzi hypothetical protein, conserved 0.0149 0.1416 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0149 0.1416 1
Loa Loa (eye worm) hypothetical protein 0.014 0.1322 0.1651
Echinococcus granulosus peregrin 0.0024 0.0129 0.0207
Echinococcus granulosus pyruvate kinase 0.0026 0.015 0.024
Echinococcus multilocularis para nitrobenzyl esterase 0.0073 0.0636 0.1027
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0101 0.0917 0.2079
Schistosoma mansoni jumonji/arid domain-containing protein 0.0031 0.0202 0.0435
Loa Loa (eye worm) bromodomain containing protein 0.0015 0.0033 0.0004
Brugia malayi Carboxylesterase family protein 0.0073 0.0636 0.0612
Loa Loa (eye worm) MH2 domain-containing protein 0.0101 0.0924 0.1143
Loa Loa (eye worm) hypothetical protein 0.0042 0.0312 0.036
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0073 0.0636 0.1027
Brugia malayi hypothetical protein 0.0059 0.0487 0.0462
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0149 0.1416 0.3226
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Onchocerca volvulus 0.0149 0.1416 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0022 0.0107 0.0676
Onchocerca volvulus 0.0073 0.0636 0.4036
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0149 0.1416 0.1394
Echinococcus multilocularis acetylcholinesterase 0.0435 0.4364 0.7047
Onchocerca volvulus Pyruvate kinase homolog 0.0026 0.015 0.032
Plasmodium vivax pyruvate kinase, putative 0.0026 0.015 0.0947
Brugia malayi exodeoxyribonuclease III family protein 0.0029 0.018 0.0154
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0029 0.018 0.0192
Mycobacterium tuberculosis Conserved protein 0.0149 0.1416 0.1325
Echinococcus granulosus beta LACTamase domain containing family member 0.0149 0.1416 0.2262
Echinococcus granulosus lysine specific demethylase 5A 0.0031 0.0202 0.0322
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0149 0.1416 0.1772
Echinococcus multilocularis muscleblind protein 1 0.0129 0.1207 0.1949
Brugia malayi RNA binding protein 0.0051 0.0405 0.0379
Brugia malayi hypothetical protein 0.0022 0.0107 0.0081
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0073 0.0636 0.1434
Loa Loa (eye worm) hypothetical protein 0.0022 0.0109 0.0101
Brugia malayi TAR-binding protein 0.0051 0.0405 0.0379
Schistosoma mansoni zinc finger protein 0.0019 0.0078 0.015
Schistosoma mansoni hypothetical protein 0.0018 0.0059 0.0107
Mycobacterium ulcerans aldehyde dehydrogenase 0.0049 0.0387 0.1054
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0014 0.0028 0.0045
Schistosoma mansoni hypothetical protein 0.0065 0.0546 0.1227
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0065 0.0546 0.0873
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0435 0.4364 1
Schistosoma mansoni hypothetical protein 0.013 0.1216 0.2766
Trichomonas vaginalis spcc417.12 protein, putative 0.0073 0.0636 0.3839
Onchocerca volvulus 0.0073 0.0636 0.4036
Echinococcus granulosus PHD finger protein rhinoceros 0.0022 0.0109 0.0173
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0153 0.1462 0.236
Mycobacterium ulcerans lipase LipD 0.0149 0.1416 0.5625
Leishmania major pyruvate kinase 0.0026 0.015 0.0983
Trypanosoma brucei hypothetical protein, conserved 0.0149 0.1416 1
Mycobacterium tuberculosis Probable lipase LipD 0.0149 0.1416 0.1325
Brugia malayi Bromodomain containing protein 0.0024 0.0129 0.0103
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0073 0.0636 0.3839
Brugia malayi Pyruvate kinase, muscle isozyme 0.0026 0.015 0.0125
Onchocerca volvulus 0.0149 0.1416 1
Echinococcus multilocularis pyruvate kinase 0.0014 0.0018 0.0029
Treponema pallidum exodeoxyribonuclease (exoA) 0.0029 0.018 0.5
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0073 0.0632 0.101
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0031 0.0193 0.0312
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0153 0.1462 0.2335
Echinococcus multilocularis neuroligin 0.0073 0.0636 0.1027
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0153 0.1462 0.3331
Onchocerca volvulus 0.0073 0.0636 0.4036
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0059 0.0487 0.0778
Echinococcus granulosus hypothetical protein 0.0618 0.626 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0014 0.0028 0.0044
Entamoeba histolytica hypothetical protein 0.0059 0.0487 1
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0053 0.0429 0.0693
Trypanosoma cruzi hypothetical protein, conserved 0.0149 0.1416 1
Echinococcus granulosus geminin 0.013 0.1216 0.1943
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0053 0.0429 0.0686
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0022 0.0104 0.0168
Schistosoma mansoni cpg binding protein 0.0052 0.0413 0.092
Loa Loa (eye worm) hypothetical protein 0.006 0.0498 0.0598
Loa Loa (eye worm) TAR-binding protein 0.0051 0.0405 0.0479
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0049 0.0387 0.0626
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Brugia malayi Carboxylesterase family protein 0.0073 0.0636 0.0612
Loa Loa (eye worm) RNA binding protein 0.0051 0.0405 0.0479
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0031 0.0193 0.0309
Mycobacterium tuberculosis Probable hydrolase 0.0149 0.1416 0.1325
Loa Loa (eye worm) hypothetical protein 0.0435 0.4364 0.5539
Loa Loa (eye worm) pyruvate kinase-PB 0.0018 0.0068 0.0049
Schistosoma mansoni tar DNA-binding protein 0.0051 0.0405 0.0901
Echinococcus granulosus acetylcholinesterase 0.0435 0.4364 0.6971
Loa Loa (eye worm) PHD-finger family protein 0.0018 0.0059 0.0037
Loa Loa (eye worm) carboxylesterase 0.0435 0.4364 0.5539
Brugia malayi Calcitonin receptor-like protein seb-1 0.0205 0.199 0.1969
Schistosoma mansoni tar DNA-binding protein 0.0051 0.0405 0.0901
Mycobacterium tuberculosis Probable lipase LipE 0.0149 0.1416 0.1325
Echinococcus multilocularis GPCR, family 2 0.0065 0.0546 0.0882
Mycobacterium ulcerans short chain dehydrogenase 0.0244 0.24 1
Loa Loa (eye worm) hypothetical protein 0.0065 0.0546 0.066
Schistosoma mansoni jumonji/arid domain-containing protein 0.0031 0.0202 0.0435
Loa Loa (eye worm) pyruvate kinase 0.0026 0.015 0.0154
Brugia malayi Bromodomain containing protein 0.0066 0.0563 0.0539
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.0546 0.0522
Trypanosoma cruzi PAB1-binding protein , putative 0.0022 0.0107 0.0676
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0015 0.003 0.0048
Echinococcus multilocularis geminin 0.013 0.1216 0.1964
Loa Loa (eye worm) carboxylesterase 0.0073 0.0636 0.0775
Loa Loa (eye worm) hypothetical protein 0.0129 0.1207 0.1505
Echinococcus granulosus fetal alzheimer antigen falz 0.0022 0.0104 0.0166
Loa Loa (eye worm) hypothetical protein 0.0039 0.028 0.032
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0029 0.018 0.5
Echinococcus multilocularis tumor protein p63 0.0287 0.2839 0.4584
Echinococcus granulosus tar DNA binding protein 0.0051 0.0405 0.0646
Brugia malayi PHD-finger family protein 0.0022 0.0109 0.0083
Echinococcus multilocularis BC026374 protein (S09 family) 0.0073 0.0636 0.1027
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0153 0.1462 0.236
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0029 0.018 0.116
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0016 0.0038 0.006
Schistosoma mansoni alzheimer's disease beta-amyloid related 0.0358 0.3569 0.8173
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0952 0.9702 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0049 0.0387 0.0619
Giardia lamblia Pyruvate kinase 0.0026 0.015 0.8161
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0029 0.018 0.0031
Schistosoma mansoni methyl-cpg binding protein mbd 0.0014 0.0028 0.0035
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0029 0.018 0.0288
Toxoplasma gondii PHD-finger domain-containing protein 0.0022 0.0109 0.0648
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0073 0.0636 0.1434
Schistosoma mansoni hypothetical protein 0.0022 0.0109 0.0221
Echinococcus granulosus BC026374 protein S09 family 0.0073 0.0636 0.1016
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0051 0.0405 0.0479
Loa Loa (eye worm) hypothetical protein 0.0018 0.0068 0.0049
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Schistosoma mansoni jumonji domain containing protein 0.0058 0.0477 0.1068
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0153 0.1462 0.2335
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0073 0.0636 0.1016
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0205 0.199 0.2505
Trypanosoma cruzi pyruvate kinase 2, putative 0.0026 0.015 0.0983
Schistosoma mansoni tar DNA-binding protein 0.0051 0.0405 0.0901
Echinococcus multilocularis cpg binding protein 0.0052 0.0413 0.0666
Trypanosoma brucei pyruvate kinase 1, putative 0.0026 0.015 0.0983
Loa Loa (eye worm) jmjC domain-containing protein 0.0031 0.0202 0.022
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0075 0.0144
Mycobacterium tuberculosis Probable esterase LipL 0.0149 0.1416 0.1325
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0149 0.1416 0.1325
Toxoplasma gondii PHD-finger domain-containing protein 0.0022 0.0109 0.0648
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0073 0.0636 0.1434
Plasmodium falciparum ataxin-2 like protein, putative 0.0022 0.0107 0.5503
Schistosoma mansoni hypothetical protein 0.0059 0.0487 0.109
Plasmodium falciparum pyruvate kinase 0.0026 0.015 0.8161
Onchocerca volvulus 0.0073 0.0636 0.4036
Schistosoma mansoni cpg binding protein 0.0047 0.0368 0.0817
Brugia malayi beta-lactamase family protein 0.0149 0.1416 0.1394
Echinococcus granulosus neuroligin 0.0073 0.0636 0.1016
Loa Loa (eye worm) hypothetical protein 0.0026 0.015 0.0154
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Brugia malayi Bromodomain containing protein 0.0033 0.0214 0.0188
Schistosoma mansoni pyruvate kinase 0.0026 0.015 0.0317
Loa Loa (eye worm) hypothetical protein 0.0205 0.199 0.2505
Entamoeba histolytica hypothetical protein 0.0059 0.0487 1
Loa Loa (eye worm) acetylcholinesterase 1 0.0435 0.4364 0.5539
Mycobacterium tuberculosis Conserved protein 0.0149 0.1416 0.1325
Brugia malayi RNA recognition motif domain containing protein 0.0051 0.0405 0.0379
Onchocerca volvulus 0.0042 0.0312 0.1554
Leishmania major hypothetical protein, conserved 0.0149 0.1416 1
Schistosoma mansoni hypothetical protein 0.0065 0.0546 0.1227
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0029 0.018 1
Plasmodium vivax hypothetical protein, conserved 0.0149 0.1416 1
Leishmania major hypothetical protein, conserved 0.0022 0.0107 0.0676
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.0546 0.066
Schistosoma mansoni acetylcholinesterase 0.0073 0.0636 0.1434
Loa Loa (eye worm) hypothetical protein 0.0149 0.1416 0.1772
Brugia malayi CXXC zinc finger family protein 0.0047 0.0368 0.0343
Echinococcus multilocularis pyruvate kinase 0.0014 0.0018 0.0029
Echinococcus multilocularis acetylcholinesterase 0.0435 0.4364 0.7047
Echinococcus granulosus tumor protein p63 0.0287 0.2839 0.4535
Trichomonas vaginalis D-aminoacylase, putative 0.0149 0.1416 1
Chlamydia trachomatis pyruvate kinase 0.0026 0.015 0.5
Brugia malayi Pyruvate kinase, M2 isozyme 0.0026 0.015 0.0125
Schistosoma mansoni hypothetical protein 0.013 0.1216 0.2766
Entamoeba histolytica hypothetical protein 0.0059 0.0487 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0046 0.0354 0.0414
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0073 0.0636 0.0509
Schistosoma mansoni cpg binding protein 0.0052 0.0413 0.092
Brugia malayi Carboxylesterase family protein 0.0435 0.4364 0.4349
Echinococcus granulosus muscleblind protein 0.0129 0.1207 0.1928
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0029 0.018 0.1195
Brugia malayi Carboxylesterase family protein 0.0073 0.0636 0.0612
Schistosoma mansoni transcription factor LCR-F1 0.0059 0.0487 0.109
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0149 0.1416 0.1325
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0015 0.003 0.0048
Echinococcus multilocularis pyruvate kinase 0.0026 0.015 0.0243
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.0546 0.0873
Brugia malayi F/Y-rich N-terminus family protein 0.0023 0.012 0.0094
Mycobacterium ulcerans hypothetical protein 0.0149 0.1416 0.5625
Brugia malayi Carboxylesterase family protein 0.0073 0.0636 0.0612
Schistosoma mansoni bromodomain containing protein 0.0056 0.0461 0.103
Trypanosoma brucei pyruvate kinase 1 0.0026 0.015 0.0983
Schistosoma mansoni aldehyde dehydrogenase 0.0049 0.0387 0.0862
Mycobacterium ulcerans esterase/lipase LipP 0.0149 0.1416 0.5625
Loa Loa (eye worm) transcription factor SMAD2 0.0101 0.0924 0.1143
Schistosoma mansoni pyruvate kinase 0.0014 0.0018 0.0013
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.0546 0.0882
Echinococcus granulosus jumonji domain containing protein 0.0031 0.0199 0.0317
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0153 0.1462 0.3331
Loa Loa (eye worm) hypothetical protein 0.0129 0.1207 0.1505
Toxoplasma gondii LsmAD domain-containing protein 0.0022 0.0107 0.0638
Trichomonas vaginalis D-aminoacylase, putative 0.0149 0.1416 1
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0073 0.0636 0.0509
Toxoplasma gondii exonuclease III APE 0.0029 0.018 0.116
Mycobacterium ulcerans epoxide hydrolase EphA 0.0137 0.1289 0.5062
Echinococcus granulosus zinc finger protein 0.0019 0.0078 0.0124
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0029 0.018 1
Echinococcus multilocularis conserved hypothetical protein 0.0612 0.6193 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0273 0.0311
Onchocerca volvulus 0.0149 0.1416 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0149 0.1416 0.3226
Echinococcus multilocularis pyruvate kinase 0.0026 0.015 0.0243
Brugia malayi Muscleblind-like protein 0.0129 0.1207 0.1184
Brugia malayi beta-lactamase family protein 0.0149 0.1416 0.1394
Loa Loa (eye worm) pyruvate kinase 0.0026 0.015 0.0154
Echinococcus granulosus pyruvate kinase 0.0026 0.015 0.024
Loa Loa (eye worm) beta-lactamase 0.0149 0.1416 0.1772
Echinococcus granulosus histone lysine methyltransferase setb 0.0016 0.0038 0.0061
Plasmodium falciparum phd finger protein, putative 0.0022 0.0109 0.5585
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0153 0.1462 0.1439
Loa Loa (eye worm) hypothetical protein 0.0073 0.0636 0.0775
Echinococcus granulosus pyruvate kinase 0.0014 0.0018 0.0029

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 100 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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