Detailed information for compound 987406

Basic information

Technical information
  • TDR Targets ID: 987406
  • Name: 2-[4-(pyrrol-1-ylmethyl)phenyl]acetic acid
  • MW: 215.248 | Formula: C13H13NO2
  • H donors: 1 H acceptors: 2 LogP: 1.72 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)Cc1ccc(cc1)Cn1cccc1
  • InChi: 1S/C13H13NO2/c15-13(16)9-11-3-5-12(6-4-11)10-14-7-1-2-8-14/h1-8H,9-10H2,(H,15,16)
  • InChiKey: OZNXAHAONBKPJO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-(1-pyrrolylmethyl)phenyl]acetic acid
  • 2-[4-(pyrrol-1-ylmethyl)phenyl]ethanoic acid

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
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.0276 0.0675
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 0.0641 0.0641
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0024 0.0086 0.0084
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0068 0.072 0.1726
Mycobacterium ulcerans hypothetical protein 0.0106 0.1283 0.1553
Leishmania major alpha glucosidase II subunit, putative 0.0037 0.0276 0.0612
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0085 0.097 0.1533
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0175 0.5609
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0111 0.1355 0.3287
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0175 1
Echinococcus granulosus zinc finger protein 0.002 0.0029 0.0029
Loa Loa (eye worm) hypothetical protein 0.0028 0.0142 0.0223
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0018 0.0589
Echinococcus multilocularis transcription factor Dp 1 0.0039 0.0307 0.0307
Brugia malayi Glycosyl hydrolases family 31 protein 0.0167 0.2161 0.3416
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0029 0.0164 0.0164
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0273 0.0273
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0088 0.1022 0.1158
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0038 0.0288 0.0288
Brugia malayi phosphofructokinase 0.0111 0.1355 0.2142
Schistosoma mansoni DNA helicase recq1 0.0029 0.0164 0.0164
Echinococcus multilocularis muscleblind protein 0.0153 0.196 0.196
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.0301 0.0672
Loa Loa (eye worm) hypothetical protein 0.0153 0.196 0.3098
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0146 0.1864 0.4383
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0085 0.097 0.097
Echinococcus granulosus 6 phosphofructokinase 0.0111 0.1355 0.1355
Loa Loa (eye worm) apoptosis regulator protein 0.0085 0.097 0.1533
Toxoplasma gondii eukaryotic initiation factor-2B, gamma subunit, putative 0.0106 0.1283 1
Brugia malayi 6-phosphofructokinase 0.0111 0.1355 0.2142
Schistosoma mansoni blooms syndrome DNA helicase 0.0027 0.0133 0.0133
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0038 0.0288 0.0455
Loa Loa (eye worm) hypothetical protein 0.0044 0.0373 0.0589
Loa Loa (eye worm) hypothetical protein 0.0042 0.0344 0.0544
Loa Loa (eye worm) hypothetical protein 0.0085 0.097 0.1533
Loa Loa (eye worm) hypothetical protein 0.0029 0.0164 0.0259
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0273 0.0273
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0276 0.0634
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0024 0.0086 0.0167
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 0.0641 0.1014
Echinococcus multilocularis lysine specific demethylase 5A 0.006 0.0613 0.0613
Brugia malayi Bromodomain containing protein 0.0039 0.0308 0.0486
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0276 0.0675
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0146 0.1861 0.2198
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0068 0.072 0.072
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0038 0.0288 0.0665
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0029 0.0164 0.0164
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.1355 0.3287
Schistosoma mansoni hypothetical protein 0.0085 0.097 0.0969
Mycobacterium tuberculosis Conserved hypothetical protein 0.0163 0.2104 0.2561
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0309 0.4229 1
Brugia malayi 6-phosphofructokinase 0.0111 0.1355 0.2142
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0074 0.0074
Echinococcus multilocularis microtubule associated protein 2 0.0706 1 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0106 0.1283 0.1553
Schistosoma mansoni microtubule-associated protein tau 0.0706 1 1
Onchocerca volvulus 0.0096 0.114 0.1801
Brugia malayi Glycosyl hydrolases family 31 protein 0.0037 0.0276 0.0436
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.0301 0.0347
Trichomonas vaginalis DNA helicase recq, putative 0.0042 0.035 0.0857
Trichomonas vaginalis DNA helicase recq, putative 0.0032 0.0203 0.0495
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.037 0.0835
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0052 0.0496 0.1135
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0025 0.0103 0.3421
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0175 0.5813
Trypanosoma brucei hypothetical protein, conserved 0.0024 0.0086 0.0162
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0052 0.0496 0.1135
Schistosoma mansoni jumonji domain containing protein 0.006 0.0613 0.0613
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Echinococcus granulosus mitogen activated protein kinase 3 0.0052 0.0496 0.0496
Giardia lamblia Fructose-bisphosphate aldolase 0.0299 0.4085 1
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0288 0.0642
Giardia lamblia Kinase, CMGC MAPK 0.0052 0.0496 0.1176
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0052 0.0496 0.0784
Echinococcus granulosus lysine specific demethylase 5A 0.0062 0.0641 0.0641
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0288 0.0642
Echinococcus granulosus lysosomal alpha glucosidase 0.0167 0.2161 0.2161
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.0276 0.2148
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0111 0.1355 0.157
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0098 0.1165 0.1408
Leishmania major phosphopantetheinyl transferase-like protein 0.0024 0.0086 0.0162
Mycobacterium tuberculosis Probable oxidoreductase 0.0098 0.1165 0.1408
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0276 0.0675
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Mycobacterium tuberculosis Probable dehydrogenase 0.0088 0.1022 0.1232
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0309 0.4229 1
Loa Loa (eye worm) RecQ helicase 0.0042 0.035 0.0553
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0111 0.1355 0.1641
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Trypanosoma brucei trypanothione reductase 0.0039 0.0301 0.0672
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0074 0.0074
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0288 0.0705
Mycobacterium tuberculosis Conserved hypothetical protein 0.0106 0.1283 0.1553
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.006 0.0613 0.0613
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0024 0.0086 0.0668
Onchocerca volvulus 0.0085 0.0975 0.1541
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.0203 0.0438
Schistosoma mansoni zinc finger protein 0.002 0.0029 0.0029
Schistosoma mansoni hypothetical protein 0.0085 0.097 0.0969
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0039 0.0312 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0276 0.0634
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0111 0.1355 0.3174
Trypanosoma brucei glucosidase, putative 0.0037 0.0276 0.0612
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0288 0.0705
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0061 0.0626 0.0626
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.1355 0.3287
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0052 0.0496 0.1135
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0299 0.4085 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0052 0.0496 0.1135
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.003 0.0175 0.0386
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0024 0.0086 0.0668
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.072 0.1667
Echinococcus granulosus L aminoadipate semialdehyde 0.0085 0.0975 0.0975
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0038 0.0288 0.0642
Schistosoma mansoni alpha-glucosidase 0.0144 0.1824 0.1823
Schistosoma mansoni apoptosis regulator bax 0.0085 0.097 0.0969
Trichomonas vaginalis DNA helicase recq1, putative 0.0042 0.035 0.0857
Loa Loa (eye worm) phosphofructokinase 0.0111 0.1355 0.2142
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0276 0.0675
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0029 0.0164 0.1276
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0098 0.1165 0.1408
Schistosoma mansoni DNA helicase recq5 0.0029 0.0164 0.0164
Brugia malayi hypothetical protein 0.0453 0.6325 1
Brugia malayi Muscleblind-like protein 0.0153 0.196 0.3098
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0086 0.2753
Echinococcus granulosus muscleblind protein 0.0153 0.196 0.196
Plasmodium falciparum glutathione reductase 0.0039 0.0301 0.9648
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0276 0.0612
Loa Loa (eye worm) hypothetical protein 0.0453 0.6325 1
Echinococcus multilocularis mitogen activated protein kinase 3 0.0052 0.0496 0.0496
Brugia malayi jmjC domain containing protein 0.006 0.0613 0.0969
Loa Loa (eye worm) 6-phosphofructokinase 0.0111 0.1355 0.2142
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Echinococcus multilocularis 6 phosphofructokinase 0.0111 0.1355 0.1355
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.0496 0.1135
Toxoplasma gondii phosphofructokinase domain-containing protein 0.003 0.0175 0.1362
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0068 0.072 0.1138
Schistosoma mansoni hypothetical protein 0.0021 0.0045 0.0045
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0276 0.0675
Toxoplasma gondii 6-phosphofructokinase 0.003 0.0175 0.1362
Loa Loa (eye worm) hypothetical protein 0.0039 0.0309 0.0488
Echinococcus granulosus bloom syndrome protein 0.0042 0.035 0.035
Schistosoma mansoni alpha glucosidase 0.0037 0.0276 0.0276
Onchocerca volvulus 0.0453 0.6325 1
Brugia malayi Thioredoxin reductase 0.0039 0.0301 0.0475
Entamoeba histolytica recQ family helicase, putative 0.0032 0.0203 0.0454
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.1355 0.3316
Schistosoma mansoni ap endonuclease 0.0019 0.0018 0.0018
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.0496 0.1214
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0024 0.0086 0.0084
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0085 0.097 0.097
Loa Loa (eye worm) runx1 0.0057 0.0565 0.0892
Loa Loa (eye worm) hypothetical protein 0.0453 0.6325 1
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0018 0.0028
Mycobacterium ulcerans 6-phosphofructokinase 0.0111 0.1355 0.1641
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.037 0.0835
Treponema pallidum licC protein (licC) 0.0106 0.1283 0.3112
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0175 0.5609
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0098 0.1165 0.1335
Echinococcus granulosus thioredoxin glutathione reductase 0.0039 0.0308 0.0308
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.0276 0.0675
Echinococcus multilocularis ubiquitin specific protease 41 0.0038 0.0288 0.0288
Treponema pallidum fructose-bisphosphate aldolase 0.0299 0.4085 1
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0018 0.0043
Schistosoma mansoni 6-phosphofructokinase 0.0111 0.1355 0.1354
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.0203 0.0438
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.0496 0.1214
Loa Loa (eye worm) hypothetical protein 0.0085 0.0975 0.1541
Mycobacterium ulcerans hypothetical protein 0.0106 0.1283 0.1553
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0024 0.0086 0.2854
Mycobacterium leprae Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.058 0.8164 1
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.1355 0.3316
Echinococcus multilocularis L aminoadipate semialdehyde 0.0085 0.0975 0.0975
Echinococcus multilocularis neutral alpha glucosidase AB 0.0037 0.0276 0.0276
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0167 0.2161 0.3416
Trypanosoma brucei protein kinase, putative 0.0052 0.0496 0.1135
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0032 0.0203 0.0438
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0024 0.0086 0.0084
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0175 0.5813
Echinococcus multilocularis lysosomal alpha glucosidase 0.0167 0.2161 0.2161
Brugia malayi jmjC domain containing protein 0.0062 0.0641 0.1014
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0018 0.0018
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0038 0.0288 0.0665
Toxoplasma gondii exonuclease III APE 0.0019 0.0018 0.0138
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0085 0.097 0.097
Brugia malayi MAP kinase sur-1 0.0052 0.0496 0.0784
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0061 0.0626 0.0626
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0288 0.0288
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0288 0.0288
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.0301 0.0475
Toxoplasma gondii hypothetical protein 0.005 0.0463 0.3604
Trichomonas vaginalis 6-phosphofructokinase, putative 0.003 0.0175 0.0428
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.1355 0.3316
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Loa Loa (eye worm) glutathione reductase 0.0039 0.0301 0.0475
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.072 0.1667
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0276 0.0675
Trichomonas vaginalis phosphofructokinase, putative 0.0111 0.1355 0.3316
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0276 0.0612
Plasmodium falciparum thioredoxin reductase 0.0039 0.0301 0.9648
Echinococcus multilocularis zinc finger protein 0.002 0.0029 0.0029
Entamoeba histolytica phosphofructokinase, putative 0.0111 0.1355 0.3287
Echinococcus multilocularis lysosomal alpha glucosidase 0.0167 0.2161 0.2161
Mycobacterium tuberculosis Probable reductase 0.0088 0.1022 0.1232
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0029 0.0164 0.0259
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0038 0.0288 0.0288
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Echinococcus multilocularis mitogen activated protein kinase 0.0052 0.0496 0.0496
Leishmania major trypanothione reductase 0.0039 0.0301 0.0672
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0024 0.0086 0.0084
Echinococcus granulosus neutral alpha glucosidase AB 0.0037 0.0276 0.0276
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0276 0.0675
Schistosoma mansoni bromodomain containing protein 0.0065 0.0679 0.0679
Leishmania major mitochondrial DNA polymerase beta 0.0309 0.4229 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0085 0.097 0.097
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0068 0.072 0.072
Plasmodium vivax glutathione reductase, putative 0.0039 0.0301 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0018 0.0018
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0029 0.0164 0.5256
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0085 0.0975 0.0974
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0146 0.1864 0.4383
Loa Loa (eye worm) hypothetical protein 0.0153 0.196 0.3098
Wolbachia endosymbiont of Brugia malayi N-acetylglucosamine-1-phosphate uridyltransferase 0.058 0.8164 1
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU 0.058 0.8164 1
Schistosoma mansoni lozenge 0.0057 0.0565 0.0564
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0068 0.072 0.1667
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0052 0.0496 0.1135
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0088 0.1022 0.1232
Loa Loa (eye worm) 6-phosphofructokinase 0.0111 0.1355 0.2142
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.0301 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0039 0.0308 0.0308
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0146 0.1861 0.2263
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0085 0.0975 0.1541
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0029 0.0164 0.0259
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.037 0.0835
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0001 0.0001
Echinococcus multilocularis muscleblind protein 1 0.0153 0.196 0.196
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0029 0.0164 0.0164
Echinococcus multilocularis bloom syndrome protein 0.0042 0.035 0.035
Echinococcus granulosus mitogen activated protein kinase 0.0052 0.0496 0.0496
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0088 0.1022 0.1232
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0045 0.0071
Brugia malayi Bromodomain containing protein 0.0077 0.0854 0.1349
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0029 0.0164 0.1276
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0038 0.0288 0.0288
Echinococcus granulosus transcription factor Dp 1 0.0039 0.0307 0.0307
Toxoplasma gondii thioredoxin reductase 0.0039 0.0301 0.2342
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0068 0.072 0.1138
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.037 0.0835
Brugia malayi Bloom's syndrome protein homolog 0.0042 0.035 0.0553
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0052 0.0496 0.3864
Entamoeba histolytica hypothetical protein 0.0024 0.0086 0.0167
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0276 0.0675
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.006 0.0613 0.0613
Mycobacterium ulcerans molybdopterin-guanine dinucleotide biosynthesis protein A 0.0106 0.1283 0.1553
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0068 0.072 0.072
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0309 0.4229 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0053 0.0508 0.1163
Brugia malayi glutathione reductase 0.0039 0.0301 0.0475
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.0276 0.0436
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0029 0.0164 0.0164
Schistosoma mansoni serine/threonine protein kinase 0.0052 0.0496 0.0496
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0018 0.0568
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0299 0.4085 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0068 0.072 0.1667
Leishmania major ATP-dependent phosphofructokinase 0.0111 0.1355 0.3174
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0146 0.1861 0.2263
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 0.0641 0.0641
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0029 0.0164 0.0259
Toxoplasma gondii phosphofructokinase PFKII 0.003 0.0175 0.1362
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0299 0.4085 1
Schistosoma mansoni memapsin-2 (A01 family) 0.0449 0.6261 0.6261
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0088 0.1022 0.1232
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0111 0.1355 0.3174
Loa Loa (eye worm) hypothetical protein 0.0038 0.0288 0.0455
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0088 0.1022 0.1232
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.0496 0.1214
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.0496 0.1214
Mycobacterium ulcerans hypothetical protein 0.0163 0.2104 0.2561
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.003 0.0175 0.0386
Schistosoma mansoni hypothetical protein 0.0085 0.097 0.0969
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.0496 0.1135
Mycobacterium ulcerans bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase 0.058 0.8164 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0038 0.0288 0.0705
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0025 0.0095 0.0737
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0074 0.0073
Schistosoma mansoni ap endonuclease 0.0019 0.0018 0.0018
Brugia malayi PHD-finger family protein 0.0025 0.0109 0.0172
Schistosoma mansoni alpha-glucosidase 0.0144 0.1824 0.1823
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0175 0.0428
Echinococcus multilocularis Protein lozenge 0.0057 0.0565 0.0565
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0146 0.1864 0.4383
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0085 0.097 0.0969
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0018 0.0028
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0038 0.0288 0.0288
Schistosoma mansoni 6-phosphofructokinase 0.0111 0.1355 0.1354
Loa Loa (eye worm) hypothetical protein 0.0072 0.079 0.1249
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.003 0.0175 0.0386
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0038 0.0288 0.0642
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0018 0.0043
Giardia lamblia Sgs1 DNA helicase, putative 0.0029 0.0164 0.0359
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0175 1
Echinococcus granulosus ubiquitin specific protease 41 0.0038 0.0288 0.0288

Activities

Activity type Activity value Assay description Source Reference
CC50 (ADMET) = 465.12 uM Cytotoxicity against human MT2 cells after 4 days by XTT assay ChEMBL. 19053778

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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