Detailed information for compound 994361

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 445.477 | Formula: C24H26F3N3O2
  • H donors: 0 H acceptors: 2 LogP: 3.71 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CC(C(=O)N1CCCN1CCN(CC1)c1ccccc1)c1ccccc1C(F)(F)F
  • InChi: 1S/C24H26F3N3O2/c25-24(26,27)21-10-5-4-9-19(21)20-17-22(31)30(23(20)32)12-6-11-28-13-15-29(16-14-28)18-7-2-1-3-8-18/h1-5,7-10,20H,6,11-17H2
  • InChiKey: DWHXMIQHORRZEV-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
Brugia malayi jmjC domain containing protein 0.0063 0.0649 0.1025
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0283 0.0693
Brugia malayi phosphofructokinase 0.0113 0.1361 0.2151
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.009 0.1028 0.1232
Brugia malayi 6-phosphofructokinase 0.0113 0.1361 0.2151
Plasmodium falciparum thioredoxin reductase 0.0039 0.0308 0.9657
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0503 0.1231
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.0633 0.0633
Brugia malayi jmjC domain containing protein 0.0061 0.062 0.098
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0283 0.0693
Giardia lamblia Kinase, CMGC MAPK 0.0053 0.0503 0.1176
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0081 0.0081
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0024 0.0094 0.0084
Echinococcus multilocularis mitogen activated protein kinase 3 0.0053 0.0503 0.0503
Treponema pallidum licC protein (licC) 0.0108 0.129 0.3112
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0024 0.0094 0.0167
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0086 0.0977 0.0977
Echinococcus granulosus 6 phosphofructokinase 0.0113 0.1361 0.1361
Loa Loa (eye worm) hypothetical protein 0.003 0.0172 0.0271
Schistosoma mansoni hypothetical protein 0.0086 0.0977 0.0977
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.0283 0.0448
Echinococcus granulosus transcription factor Dp 1 0.004 0.0314 0.0314
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0038 0.0296 0.0296
Giardia lamblia Fructose-bisphosphate aldolase 0.0303 0.4089 1
Treponema pallidum fructose-bisphosphate aldolase 0.0303 0.4089 1
Echinococcus multilocularis zinc finger protein 0.002 0.0037 0.0037
Schistosoma mansoni lozenge 0.0058 0.0572 0.0572
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0024 0.0094 0.0726
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0113 0.1361 0.157
Loa Loa (eye worm) RecQ helicase 0.0043 0.0358 0.0565
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0053 0.0503 0.1135
Echinococcus granulosus muscleblind protein 0.0155 0.1966 0.1966
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0053 0.0503 0.1135
Schistosoma mansoni DNA helicase recq1 0.003 0.0172 0.0172
Brugia malayi glutathione reductase 0.0039 0.0308 0.0487
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0148 0.1868 0.2263
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.009 0.1028 0.1232
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0283 0.0693
Entamoeba histolytica phosphofructokinase, putative 0.0113 0.1361 0.3287
Loa Loa (eye worm) hypothetical protein 0.0155 0.1966 0.3107
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0314 0.4234 1
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0086 0.0977 0.0977
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.0649 0.1025
Trichomonas vaginalis DNA helicase recq1, putative 0.0043 0.0358 0.0875
Trichomonas vaginalis maltase-glucoamylase, putative 0.0038 0.0283 0.0693
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0283 0.0634
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0061 0.062 0.062
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0283 0.0693
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.0283 0.0283
Mycobacterium ulcerans hypothetical protein 0.0108 0.129 0.1553
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.0308 0.0672
Loa Loa (eye worm) hypothetical protein 0.0042 0.0352 0.0556
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0296 0.0723
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.2167 0.2167
Mycobacterium tuberculosis Putative ferredoxin reductase 0.009 0.1028 0.1232
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0061 0.062 0.062
Schistosoma mansoni alpha-glucosidase 0.0146 0.183 0.183
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.0283 0.2197
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0024 0.0094 0.0726
Echinococcus multilocularis mitogen activated protein kinase 0.0053 0.0503 0.0503
Brugia malayi Muscleblind-like protein 0.0155 0.1966 0.3107
Echinococcus multilocularis 6 phosphofructokinase 0.0113 0.1361 0.1361
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0069 0.0727 0.1726
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.003 0.0172 0.0172
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.0377 0.0835
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 0.0588 0.8166 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Loa Loa (eye worm) glutathione reductase 0.0039 0.0308 0.0487
Echinococcus granulosus thioredoxin glutathione reductase 0.004 0.0316 0.0316
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.01 0.1171 0.1408
Brugia malayi Bromodomain containing protein 0.0078 0.0861 0.136
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0069 0.0727 0.0727
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0053 0.0503 0.1135
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0183 0.5922
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0026 0.0026
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0148 0.1868 0.2198
Loa Loa (eye worm) hypothetical protein 0.0086 0.0977 0.1544
Trichomonas vaginalis phosphofructokinase, putative 0.0113 0.1361 0.3329
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0026 0.0805
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0086 0.0977 0.1544
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0113 0.1361 0.3174
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0503 0.1231
Echinococcus multilocularis lysosomal alpha glucosidase 0.0169 0.2167 0.2167
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0086 0.0977 0.0977
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0377 0.0835
Leishmania major phosphopantetheinyl transferase-like protein 0.0024 0.0094 0.0162
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0086 0.0982 0.0982
Toxoplasma gondii 6-phosphofructokinase 0.003 0.0183 0.1415
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0113 0.1361 0.3287
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0069 0.0727 0.1149
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.009 0.1028 0.1232
Loa Loa (eye worm) 6-phosphofructokinase 0.0113 0.1361 0.2151
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0727 0.1667
Trypanosoma brucei trypanothione reductase 0.0039 0.0308 0.0672
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0183 1
Trichomonas vaginalis phosphofructokinase, putative 0.0113 0.1361 0.3329
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0296 0.0296
Brugia malayi Bloom's syndrome protein homolog 0.0043 0.0358 0.0565
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0069 0.0727 0.0727
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Echinococcus multilocularis Protein lozenge 0.0058 0.0572 0.0572
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0283 0.0693
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0009 0.0014
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0038 0.0296 0.0665
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0377 0.0835
Mycobacterium ulcerans hypothetical protein 0.0108 0.129 0.1553
Entamoeba histolytica phosphofructokinase, putative 0.0113 0.1361 0.3287
Schistosoma mansoni jumonji domain containing protein 0.0061 0.062 0.062
Schistosoma mansoni hypothetical protein 0.0086 0.0977 0.0977
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Brugia malayi Thioredoxin reductase 0.0039 0.0308 0.0487
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0148 0.187 0.4383
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0303 0.4089 1
Schistosoma mansoni alpha-glucosidase 0.0146 0.183 0.183
Echinococcus multilocularis bloom syndrome protein 0.0043 0.0358 0.0358
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0283 0.0693
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0026 0.0041
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0018 0.0008 0.0008
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.0308 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0283 0.0612
Schistosoma mansoni alpha glucosidase 0.0038 0.0283 0.0283
Toxoplasma gondii thioredoxin reductase 0.0039 0.0308 0.239
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase 0.0588 0.8166 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.003 0.0172 0.5375
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0183 1
Leishmania major ATP-dependent phosphofructokinase 0.0113 0.1361 0.3174
Schistosoma mansoni ap endonuclease 0.002 0.0026 0.0026
Toxoplasma gondii exonuclease III APE 0.002 0.0026 0.0199
Echinococcus multilocularis lysine specific demethylase 5A 0.0061 0.062 0.062
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.021 0.0438
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0283 0.0634
Schistosoma mansoni jumonji/arid domain-containing protein 0.0063 0.0649 0.0649
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.01 0.1171 0.1408
Trichomonas vaginalis DNA helicase recq, putative 0.0043 0.0358 0.0875
Trichomonas vaginalis DNA helicase recq, putative 0.0032 0.021 0.0514
Mycobacterium leprae Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.0588 0.8166 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.003 0.0172 0.133
Toxoplasma gondii phosphofructokinase domain-containing protein 0.003 0.0183 0.1415
Mycobacterium tuberculosis Probable oxidoreductase 0.01 0.1171 0.1408
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0053 0.0503 0.3902
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0025 0.0102 0.0794
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0024 0.0094 0.0084
Trichomonas vaginalis phosphofructokinase, putative 0.0113 0.1361 0.3329
Schistosoma mansoni hypothetical protein 0.0021 0.0053 0.0053
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0026 0.0026
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0183 0.5922
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0296 0.0642
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0086 0.0982 0.1551
Entamoeba histolytica recQ family helicase, putative 0.0032 0.021 0.0454
Schistosoma mansoni 6-phosphofructokinase 0.0113 0.1361 0.1361
Schistosoma mansoni memapsin-2 (A01 family) 0.0442 0.6064 0.6064
Brugia malayi 6-phosphofructokinase 0.0113 0.1361 0.2151
Echinococcus multilocularis muscleblind protein 0.0155 0.1966 0.1966
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0094 0.3039
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0094 0.2935
Loa Loa (eye worm) hypothetical protein 0.0028 0.0149 0.0236
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0081 0.0081
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0024 0.0094 0.0084
Schistosoma mansoni 6-phosphofructokinase 0.0113 0.1361 0.1361
Toxoplasma gondii hypothetical protein 0.0051 0.047 0.3644
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0296 0.0723
Loa Loa (eye worm) hypothetical protein 0.046 0.6328 1
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Schistosoma mansoni zinc finger protein 0.002 0.0037 0.0037
Echinococcus granulosus lysosomal alpha glucosidase 0.0169 0.2167 0.2167
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.003 0.0183 0.0386
Echinococcus granulosus ATP dependent DNA helicase Q5 0.003 0.0172 0.0172
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0296 0.0723
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.0588 0.8166 1
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0296 0.0296
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0053 0.0503 0.0796
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0026 0.0063
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0113 0.1361 0.1641
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.028 0.028
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0303 0.4089 1
Schistosoma mansoni ap endonuclease 0.002 0.0026 0.0026
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0053 0.0084
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Echinococcus granulosus L aminoadipate semialdehyde 0.0086 0.0982 0.0982
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.021 0.0438
Schistosoma mansoni DNA helicase recq5 0.003 0.0172 0.0172
Echinococcus multilocularis muscleblind protein 1 0.0155 0.1966 0.1966
Schistosoma mansoni apoptosis regulator bax 0.0086 0.0977 0.0977
Loa Loa (eye worm) hypothetical protein 0.046 0.6328 1
Loa Loa (eye worm) apoptosis regulator protein 0.0086 0.0977 0.1544
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0148 0.187 0.4383
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0026 0.0063
Toxoplasma gondii eukaryotic initiation factor-2B, gamma subunit, putative 0.0108 0.129 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0108 0.129 0.1553
Plasmodium falciparum glutathione reductase 0.0039 0.0308 0.9657
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.003 0.0183 0.0386
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0296 0.0642
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.0308 0.0347
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0314 0.4234 1
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0069 0.0727 0.0727
Brugia malayi Bromodomain containing protein 0.004 0.0315 0.0498
Echinococcus granulosus mitogen activated protein kinase 0.0053 0.0503 0.0503
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0053 0.0503 0.1135
Trypanosoma brucei hypothetical protein, conserved 0.0024 0.0094 0.0162
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0296 0.0296
Brugia malayi Glycosyl hydrolases family 31 protein 0.0038 0.0283 0.0448
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0038 0.0296 0.0467
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0183 0.5719
Brugia malayi Glycosyl hydrolases family 31 protein 0.0169 0.2167 0.3425
Trypanosoma brucei glucosidase, putative 0.0038 0.0283 0.0612
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0283 0.0693
Toxoplasma gondii phosphofructokinase PFKII 0.003 0.0183 0.1415
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.0633 0.0633
Echinococcus multilocularis thioredoxin glutathione reductase 0.004 0.0316 0.0316
Leishmania major trypanothione reductase 0.0039 0.0308 0.0672
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0038 0.0296 0.0642
Brugia malayi PHD-finger family protein 0.0026 0.0116 0.0184
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.003 0.0183 0.0386
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0296 0.0296
Echinococcus multilocularis microtubule associated protein 2 0.0717 1 1
Mycobacterium ulcerans molybdopterin-guanine dinucleotide biosynthesis protein A 0.0108 0.129 0.1553
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0727 0.1667
Trichomonas vaginalis 6-phosphofructokinase, putative 0.003 0.0183 0.0447
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.021 0.0438
Loa Loa (eye worm) hypothetical protein 0.004 0.0316 0.05
Mycobacterium tuberculosis Probable reductase 0.009 0.1028 0.1232
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0026 0.0041
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.004 0.0319 1
Onchocerca volvulus 0.0098 0.1146 0.1812
Loa Loa (eye worm) ATP-dependent DNA helicase 0.003 0.0172 0.0271
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.003 0.0172 0.0271
Mycobacterium tuberculosis Conserved hypothetical protein 0.0108 0.129 0.1553
Loa Loa (eye worm) hypothetical protein 0.0155 0.1966 0.3107
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0503 0.0503
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.0283 0.0612
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0503 0.1231
Schistosoma mansoni bromodomain containing protein 0.0066 0.0687 0.0687
Onchocerca volvulus 0.046 0.6328 1
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0025 0.0111 0.3592
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.0283 0.0283
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Loa Loa (eye worm) phosphofructokinase 0.0113 0.1361 0.2151
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0053 0.0503 0.1135
Loa Loa (eye worm) 6-phosphofructokinase 0.0113 0.1361 0.2151
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0169 0.2167 0.3425
Loa Loa (eye worm) hypothetical protein 0.0038 0.0296 0.0467
Loa Loa (eye worm) hypothetical protein 0.0086 0.0982 0.1551
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0081 0.0081
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0069 0.0727 0.1667
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.0308 0.0487
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0296 0.0642
Loa Loa (eye worm) hypothetical protein 0.0073 0.0797 0.126
Echinococcus multilocularis transcription factor Dp 1 0.004 0.0314 0.0314
Echinococcus granulosus mitogen activated protein kinase 3 0.0053 0.0503 0.0503
Mycobacterium tuberculosis Probable dehydrogenase 0.009 0.1028 0.1232
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0026 0.0834
Schistosoma mansoni jumonji/arid domain-containing protein 0.0063 0.0649 0.0649
Echinococcus granulosus ATP dependent DNA helicase Q1 0.003 0.0172 0.0172
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0069 0.0727 0.1149
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0183 0.0447
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0018 0.0008 0.0008
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.003 0.0172 0.133
Echinococcus multilocularis L aminoadipate semialdehyde 0.0086 0.0982 0.0982
Loa Loa (eye worm) hypothetical protein 0.0044 0.038 0.06
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0054 0.0515 0.1163
Entamoeba histolytica hypothetical protein 0.0024 0.0094 0.0167
Trichomonas vaginalis phosphofructokinase, putative 0.0113 0.1361 0.3329
Echinococcus granulosus bloom syndrome protein 0.0043 0.0358 0.0358
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0148 0.187 0.4383
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.028 0.028
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0024 0.0094 0.0084
Mycobacterium ulcerans 6-phosphofructokinase 0.0113 0.1361 0.1641
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.0377 0.0835
Mycobacterium tuberculosis Conserved hypothetical protein 0.0165 0.211 0.2561
Loa Loa (eye worm) runx1 0.0058 0.0572 0.0904
Schistosoma mansoni hypothetical protein 0.0086 0.0977 0.0977
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0148 0.1868 0.2263
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0314 0.4234 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0283 0.0612
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.003 0.0172 0.0172
Schistosoma mansoni blooms syndrome DNA helicase 0.0028 0.0141 0.0141
Echinococcus granulosus lysine specific demethylase 5A 0.0063 0.0649 0.0649
Echinococcus granulosus ubiquitin specific protease 41 0.0038 0.0296 0.0296
Schistosoma mansoni microtubule-associated protein tau 0.0717 1 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.009 0.1028 0.1158
Echinococcus granulosus zinc finger protein 0.002 0.0037 0.0037
Brugia malayi MAP kinase sur-1 0.0053 0.0503 0.0796
Brugia malayi hypothetical protein 0.046 0.6328 1
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0038 0.0296 0.0665
Leishmania major mitochondrial DNA polymerase beta 0.0314 0.4234 1
Entamoeba histolytica phosphofructokinase, putative 0.0113 0.1361 0.3287
Plasmodium vivax glutathione reductase, putative 0.0039 0.0308 1
Echinococcus multilocularis ubiquitin specific protease 41 0.0038 0.0296 0.0296
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0086 0.0977 0.0977
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0053 0.0503 0.1135
Trichomonas vaginalis sucrase-isomaltase, putative 0.0038 0.0283 0.0693
Trichomonas vaginalis CMGC family protein kinase 0.0053 0.0503 0.1231
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0113 0.1361 0.3174
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0183 0.5719
Trypanosoma brucei protein kinase, putative 0.0053 0.0503 0.1135
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0303 0.4089 1
Onchocerca volvulus 0.0086 0.0982 0.1551
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.01 0.1171 0.1335
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0086 0.0977 0.0977
Mycobacterium ulcerans hypothetical protein 0.0165 0.211 0.2561
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0069 0.0727 0.1667
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0038 0.0296 0.0296
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0053 0.0503 0.1135
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.003 0.0172 0.0271
Giardia lamblia Sgs1 DNA helicase, putative 0.003 0.0172 0.0359

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 300 mg Kg-1 Anticonvulsant activity in ip dosed CF1 albino mouse assessed as inhibition of maximal electroshock-induced seizures after 0.5 hrs ChEMBL. 18603334
Activity (ADMET) = 300 mg Kg-1 Neurotoxicity in ip dosed CF1 albino mouse assessed as ability to maintain equilibrium for 1 min on maze after 0.5 hrs by rotarod test ChEMBL. 18603334

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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