Detailed information for compound 1377652

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 436.31 | Formula: C14H10BrN7OS2
  • H donors: 2 H acceptors: 6 LogP: 2.93 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1nnc(s1)C)CSc1n[nH]c2c(n1)nc1c2cc(cc1)Br
  • InChi: 1S/C14H10BrN7OS2/c1-6-19-22-14(25-6)17-10(23)5-24-13-18-12-11(20-21-13)8-4-7(15)2-3-9(8)16-12/h2-4,20H,5H2,1H3,(H,17,22,23)
  • InChiKey: ULTXLPYNNVKDBU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Trypanosoma brucei methionyl-tRNA synthetase, putative Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed), beta Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans mitochondrial tRNA methionyl-tRNA synthetase similar to S. cerevisiae MSM1 (YGR171C) mitochondrial methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis methionine tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Schistosoma japonicum ko:K01874 methionyl-tRNA synthetase [EC6.1.1.10], putative Get druggable targets OG5_127468 All targets in OG5_127468
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) Get druggable targets OG5_127468 All targets in OG5_127468
Mycobacterium ulcerans hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Brugia malayi methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis methionine-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Onchocerca volvulus Get druggable targets OG5_127468 All targets in OG5_127468
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma congolense methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Cryptosporidium parvum methionyl-tRNA synthetase of possible bacterial origin Get druggable targets OG5_127468 All targets in OG5_127468
Trypanosoma brucei gambiense mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus methionine tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Leishmania infantum mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis methionine -- tRNA ligase Get druggable targets OG5_127468 All targets in OG5_127468
Leishmania braziliensis mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Loa Loa (eye worm) methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium tuberculosis Conserved hypothetical protein Get druggable targets OG5_130965 All targets in OG5_130965
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax methionine--tRNA ligase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Candida albicans mitochondrial tRNA methionyl-tRNA synthetase similar to S. cerevisiae MSM1 (YGR171C) mitochondrial methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Babesia bovis methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma congolense mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Trypanosoma brucei gambiense methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium knowlesi methionine--tRNA ligase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium leprae Probable methionyl-tRNA synthase MetS Get druggable targets OG5_127468 All targets in OG5_127468
Leishmania braziliensis methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei methionine--tRNA ligase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum methionine--tRNA ligase Get druggable targets OG5_127468 All targets in OG5_127468
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi methionyl-tRNA synthetase, putative Get druggable targets OG5_127468 All targets in OG5_127468
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Leishmania major mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Schistosoma mansoni methionine-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Loa Loa (eye worm) tyrosyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Leishmania mexicana mitochondrial DNA polymerase beta Get druggable targets OG5_130965 All targets in OG5_130965
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum Methionine--tRNA ligase (EC 6.1.1.10), related Get druggable targets OG5_127468 All targets in OG5_127468
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Mycobacterium ulcerans methionyl-tRNA synthetase Get druggable targets OG5_127468 All targets in OG5_127468
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative Get druggable targets OG5_130965 All targets in OG5_130965
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative polymerase (DNA directed), beta 335 aa 303 aa 32.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0342 0.0765
Plasmodium falciparum methionine--tRNA ligase, putative 0.0025 0.0537 0.2458
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0342 0.2021
Echinococcus multilocularis methionyl tRNA synthetase, cytoplasmic 0.0025 0.0537 0.1204
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1074 0.2416
Schistosoma mansoni ap endonuclease 0.0018 0.0342 0.0769
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1074 0.242
Loa Loa (eye worm) hypothetical protein 0.0025 0.0537 0.1128
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0173 0.4643 0.4499
Mycobacterium ulcerans hypothetical protein 0.0192 0.5187 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1074 0.2416
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0342 0.0716
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0342 0.0082
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0176 0.4742 1
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Schistosoma mansoni dishevelled 0.0009 0.0072 0.0161
Echinococcus multilocularis methionine tRNA synthetase 0.0066 0.1681 0.3783
Onchocerca volvulus 0.0041 0.0975 0.2052
Schistosoma mansoni z-protein (S1r protein) 0.0009 0.0072 0.0161
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0009 0.0072 0.0156
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0012 0.0164 0.034
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0072 0.0156
Schistosoma mansoni regulator of G protein signaling 0.0009 0.0072 0.0161
Toxoplasma gondii tRNA ligases class I (M) protein 0.0025 0.0537 0.3192
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0262 0.026
Schistosoma mansoni ras GTP exchange factor 0.0006 0.0002 0.0005
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0164 0.0973
Treponema pallidum methionyl-tRNA synthetase 0.0025 0.0537 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0342 0.0339
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0072 0.0156
Toxoplasma gondii hypothetical protein 0.0009 0.0072 0.0426
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1074 0.242
Brugia malayi protein ZK524.3 0.0025 0.0537 0.1128
Schistosoma mansoni ap endonuclease 0.0018 0.0342 0.0769
Toxoplasma gondii hypothetical protein 0.0059 0.147 0.8744
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0342 0.0716
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0262 0.4878
Echinococcus multilocularis bloom syndrome protein 0.0029 0.0638 0.1433
Mycobacterium ulcerans leucyl-tRNA synthetase 0.0025 0.0537 0.0403
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.0638 0.3788
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0066 0.1681 0.3543
Loa Loa (eye worm) hypothetical protein 0.0176 0.4742 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 1 1
Echinococcus multilocularis leucyl tRNA synthetase 0.0025 0.0537 0.1204
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0342 0.2021
Loa Loa (eye worm) tyrosyl-tRNA synthetase 0.0041 0.0975 0.2052
Schistosoma mansoni guanine-nucleotide-exchange-factor 0.0006 0.0002 0.0005
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1074 0.2416
Giardia lamblia Leucyl-tRNA synthetase 0.0025 0.0537 0.2458
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0002 0.0005
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0009 0.0072 0.0146
Schistosoma mansoni hypothetical protein 0.0165 0.444 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0342 0.0765
Schistosoma mansoni dishevelled 0.0009 0.0072 0.0161
Brugia malayi methionyl-tRNA synthetase 0.0066 0.1681 0.3543
Toxoplasma gondii exonuclease III APE 0.0018 0.0342 0.2032
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.054 0.2481
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0066 0.1681 1
Toxoplasma gondii methionyl-tRNA synthetase 0.0066 0.1681 1
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Echinococcus granulosus bloom syndrome protein 0.0029 0.0638 0.1433
Loa Loa (eye worm) hypothetical protein 0.0009 0.0072 0.0146
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.1074 0.2262
Mycobacterium leprae Probable methionyl-tRNA synthase MetS 0.0066 0.1681 0.5
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.037 0.2201
Brugia malayi hypothetical protein 0.0009 0.0072 0.0146
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0012 0.0164 0.0364
Schistosoma mansoni hypothetical protein 0.0165 0.444 1
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0072 0.0156
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.126 0.1258
Chlamydia trachomatis methionine--tRNA ligase 0.0025 0.0537 0.5
Schistosoma mansoni leucyl-tRNA synthetase 0.0025 0.0537 0.1209
Brugia malayi methionyl-tRNA synthetase 0.0025 0.0537 0.1128
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.4643 0.4642
Plasmodium vivax hypothetical protein, conserved 0.0025 0.0537 0.1456
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0342 0.0339
Trichomonas vaginalis DNA helicase recq, putative 0.0015 0.0262 0.1546
Giardia lamblia Methionyl-tRNA synthetase 0.0066 0.1681 1
Schistosoma mansoni DNA helicase recq5 0.0012 0.0164 0.0368
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0062 0.1573 0.1571
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0012 0.0164 0.0364
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0009 0.0072 0.0146
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0002 0.0005
Schistosoma mansoni dep domain containing protein 0.0009 0.0072 0.0161
Echinococcus granulosus segment polarity protein dishevelled 0.0009 0.0072 0.0156
Echinococcus granulosus regulator of G protein signaling 7 0.0009 0.0072 0.0156
Treponema pallidum leucyl-tRNA synthetase 0.0025 0.0537 1
Echinococcus granulosus methionyl tRNA synthetase cytoplasmic 0.0025 0.0537 0.1204
Leishmania major leucyl-tRNA synthetase, putative 0.0025 0.0537 0.0282
Loa Loa (eye worm) DIX domain-containing protein 0.0009 0.0072 0.0146
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0164 0.0973
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Loa Loa (eye worm) hypothetical protein 0.0009 0.0072 0.0146
Trypanosoma brucei methionyl-tRNA synthetase, putative 0.0066 0.1681 0.1458
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.126 0.1258
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase 0.0066 0.1681 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.1074 0.2262
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0164 0.034
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0009 0.0072 0.0161
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0072 0.0146
Echinococcus granulosus Pleckstrin G protein interacting region 0.0009 0.0072 0.0156
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0164 0.034
Onchocerca volvulus 0.0009 0.0072 0.0146
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0365 1 1
Echinococcus multilocularis segment polarity protein dishevelled 0.0009 0.0072 0.0156
Plasmodium vivax methionine--tRNA ligase, putative 0.0066 0.1681 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0051 0.126 0.1258
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Mycobacterium ulcerans methionyl-tRNA synthetase 0.0066 0.1681 0.2765
Echinococcus granulosus methionine tRNA synthetase 0.0066 0.1681 0.3783
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0012 0.0164 0.0364
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Plasmodium vivax methionine--tRNA ligase, putative 0.0025 0.0537 0.1456
Plasmodium falciparum methionine--tRNA ligase 0.0066 0.1681 1
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0173 0.4643 0.4499
Echinococcus granulosus geminin 0.0165 0.444 1
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Brugia malayi N-terminal motif family protein 0.0176 0.4742 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0342 0.6366
Wolbachia endosymbiont of Brugia malayi leucyl-tRNA synthetase 0.0025 0.0537 0.1456
Brugia malayi regulator of G-protein signaling egl-10 0.0009 0.0072 0.0146
Loa Loa (eye worm) RecQ helicase 0.0029 0.0638 0.1342
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.0638 0.1342
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0342 0.1173
Loa Loa (eye worm) hypothetical protein 0.0012 0.0164 0.034
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0342 0.1173
Entamoeba histolytica hypothetical protein 0.0006 0.0002 0.0042
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) 0.0066 0.1681 0.2765
Schistosoma mansoni methionine-tRNA synthetase 0.0066 0.1681 0.3786
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0051 0.126 0.1025
Mycobacterium tuberculosis Conserved hypothetical protein 0.0192 0.5187 1
Echinococcus multilocularis geminin 0.0165 0.444 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1074 0.2416
Brugia malayi hypothetical protein 0.0009 0.0072 0.0146
Trypanosoma cruzi methionyl-tRNA synthetase, putative 0.0066 0.1681 0.1679
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0012 0.0164 0.0364
Schistosoma mansoni methionine-tRNA synthetase 0.0025 0.0537 0.1209
Brugia malayi DIX domain containing protein 0.0009 0.0072 0.0146
Loa Loa (eye worm) hypothetical protein 0.0025 0.0537 0.1128
Chlamydia trachomatis leucine--tRNA ligase 0.0025 0.0537 0.5
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.0468 0.1054
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.002 0.0377 0.026
Leishmania major methionyl-tRNA synthetase, putative 0.0066 0.1681 0.1458
Loa Loa (eye worm) hypothetical protein 0.0009 0.0072 0.0146
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0009 0.0072 0.0146
Schistosoma mansoni ras GTP exchange factor son of sevenless 0.0006 0.0002 0.0005
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0072 0.0156
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1074 0.242
Loa Loa (eye worm) hypothetical protein 0.0146 0.3899 0.8222
Schistosoma mansoni DNA helicase recq1 0.0012 0.0164 0.0368
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0342 0.0082
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.0638 0.3788
Loa Loa (eye worm) hypothetical protein 0.0025 0.0537 0.1128
Entamoeba histolytica Ras guanine nucleotide exchange factor, putative 0.0006 0.0002 0.0042
Entamoeba histolytica methionyl-tRNA synthetase, putative 0.0025 0.0537 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0365 1 1
Echinococcus multilocularis regulator of G protein signaling 7 0.0009 0.0072 0.0156

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) 1.356 uM PubChem BioAssay. Luminescence-based biochemical high throughput dose response assay for inhibitors of Trypanosoma brucei methionyl tRNA synthetase (MetRS). (Class of assay: confirmatory) ChEMBL. No reference
IC50 (functional) 3.874 uM PubChem BioAssay. Counterscreen Fluorescent Polarization-based biochemical high throughput orthogonal dose response assay for inhibitors of Trypanosoma brucei methionyl tRNA synthetase (MetRS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 3.5481 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of DNA Polymerase Beta. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 17.7828 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.9349 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 63.0957 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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