Detailed information for compound 1555944

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 238.366 | Formula: C15H26O2
  • H donors: 2 H acceptors: 2 LogP: 3.12 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=CCCC(C1CC=C(C(C1O)O)C)C)C
  • InChi: 1S/C15H26O2/c1-10(2)6-5-7-11(3)13-9-8-12(4)14(16)15(13)17/h6,8,11,13-17H,5,7,9H2,1-4H3
  • InChiKey: SDAWXTDBEYZMMX-UHFFFAOYSA-N  


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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
Trichomonas vaginalis DNA topoisomerase II, putative 0.0248 0.0628 1
Loa Loa (eye worm) hypothetical protein 0.017 0.0406 0.2002
Entamoeba histolytica DNA topoisomerase III, putative 0.0076 0.0139 0.2213
Mycobacterium ulcerans two component sensor kinase MprB 0.0033 0.0018 0.0018
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0132 0.0298 0.1393
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0248 0.0628 0.5127
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Mycobacterium leprae Probable two component sensor kinase MprB 0.0033 0.0018 0.0018
Leishmania major mitochondrial DNA topoisomerase II 0.0614 0.1667 0.4423
Treponema pallidum DNA topoisomerase I (topA) 0.0076 0.0139 0.0121
Echinococcus granulosus o acyltransferase membrane bound domain 0.0132 0.0298 0.1393
Plasmodium falciparum DNA topoisomerase VI, b subunit, putative 0.0033 0.0018 0.0013
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0076 0.0139 0.0356
Mycobacterium tuberculosis Two component sensor kinase MprB 0.0033 0.0018 0.0018
Trypanosoma cruzi heat shock protein 85, putative 0.0033 0.0018 0.0034
Trypanosoma cruzi DNA topoisomerase III, putative 0.0076 0.0139 0.0356
Loa Loa (eye worm) hypothetical protein 0.0132 0.0298 0.1469
Trypanosoma cruzi glycerol uptake protein, putative 0.0132 0.0298 0.0778
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trichomonas vaginalis conserved hypothetical protein 0.0132 0.0298 0.4589
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0072 0.0267
Echinococcus multilocularis muscleblind protein 1 0.017 0.0406 0.1931
Trypanosoma brucei DNA topoisomerase III, putative 0.0076 0.0139 0.0356
Giardia lamblia DNA topoisomerase III 0.0076 0.0139 0.2347
Plasmodium falciparum endoplasmin, putative 0.0033 0.0018 0.0013
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0132 0.0298 0.1469
Echinococcus granulosus o acyltransferase membrane bound domain 0.0132 0.0298 0.1393
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.004 0.0324
Leishmania major DNA topoisomerase 1A 0.0076 0.0139 0.0369
Entamoeba histolytica vacuolar protein sorting 26 0.0132 0.0298 0.4744
Leishmania major hypothetical protein, conserved 0.0041 0.004 0.0105
Loa Loa (eye worm) beta-lactamase 0.0041 0.004 0.0196
Leishmania major DNA topoisomerase III, putative 0.0076 0.0139 0.0369
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Mycobacterium tuberculosis Probable hydrolase 0.0041 0.004 0.004
Loa Loa (eye worm) TOPoisomerase family member 0.0248 0.0628 0.3097
Trypanosoma brucei heat shock protein 90, putative 0.0033 0.0018 0.0034
Loa Loa (eye worm) hypothetical protein 0.0029 0.0005 0.0025
Brugia malayi MBOAT family protein 0.0132 0.0298 0.2432
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0069 0.012 0.0505
Trypanosoma brucei heat shock protein 90, putative 0.0033 0.0018 0.0034
Leishmania major polypeptide deformylase-like protein, putative 0.1354 0.3768 1
Loa Loa (eye worm) MBOAT family protein 0.0132 0.0298 0.1469
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0072 0.0267
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0458 0.1225 0.604
Mycobacterium ulcerans DNA topoisomerase I 0.0076 0.0139 0.0139
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.012 0.012
Leishmania major glycerol uptake protein, putative 0.0132 0.0298 0.0791
Giardia lamblia DNA topoisomerase III 0.0076 0.0139 0.2347
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0041 0.004 0.004
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Brugia malayi MBOAT family protein 0.0132 0.0298 0.2432
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.1354 0.3768 1
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0132 0.0298 0.1393
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0458 0.1225 0.1221
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0132 0.0298 0.1393
Mycobacterium leprae PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3 0.0033 0.0018 0.0018
Echinococcus granulosus DNA topoisomerase 3 beta 1 0.0076 0.0139 0.0602
Brugia malayi DNA topoisomerase III beta-1 0.0076 0.0139 0.1135
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.0072 0.0354
Toxoplasma gondii hypothetical protein 0.0132 0.0298 0.0293
Plasmodium vivax heat shock protein 86, putative 0.0033 0.0018 0.0013
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Entamoeba histolytica DNA topoisomerase II, putative 0.0248 0.0628 1
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Loa Loa (eye worm) heat shock protein 90 0.0033 0.0018 0.0089
Schistosoma mansoni aldehyde dehydrogenase 0.0069 0.012 0.0505
Onchocerca volvulus 0.0041 0.004 0.0633
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.012 0.012
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0614 0.1667 0.1663
Schistosoma mansoni hypothetical protein 0.0132 0.0298 0.1393
Trypanosoma cruzi Heat shock protein 83, putative 0.0033 0.0018 0.0034
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0132 0.0298 0.1393
Loa Loa (eye worm) hypothetical protein 0.0741 0.2029 1
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.1354 0.3768 1
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Trypanosoma brucei glycerol uptake protein, putative 0.0132 0.0298 0.0778
Trypanosoma cruzi Peptide deformylase 2, putative 0.1354 0.3768 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0041 0.004 0.004
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0069 0.012 0.012
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.0033 0.0018 0.0034
Brugia malayi heat shock protein 90 0.0033 0.0018 0.0147
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0248 0.0628 0.3035
Mycobacterium leprae Probable two-component sensor kinase 0.0033 0.0018 0.0018
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.004 0.0356
Plasmodium vivax DNA topoisomerase 3, putative 0.0076 0.0139 0.0134
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0033 0.0018 0.0013
Trypanosoma cruzi GUP1, putative 0.0132 0.0298 0.0778
Echinococcus granulosus DNA topoisomerase 3 alpha 0.0076 0.0139 0.0602
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0132 0.0298 0.1393
Loa Loa (eye worm) endoplasmin 0.0033 0.0018 0.0089
Trypanosoma brucei Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0033 0.0018 0.0034
Mycobacterium tuberculosis Probable lipase LipD 0.0041 0.004 0.004
Trypanosoma brucei developmentally regulated phosphoprotein 0.0033 0.0018 0.0034
Loa Loa (eye worm) hypothetical protein 0.0172 0.0413 0.2034
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0132 0.0298 0.1393
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0072 0.0267
Entamoeba histolytica hypothetical protein 0.0132 0.0298 0.4744
Loa Loa (eye worm) DNA topoisomerase III 0.0076 0.0139 0.0685
Schistosoma mansoni DNA topoisomerase II 0.0248 0.0628 0.3035
Leishmania major developmentally regulated phosphoprotein-like protein 0.0033 0.0018 0.0048
Loa Loa (eye worm) hhat protein 0.0132 0.0298 0.1469
Brugia malayi hypothetical protein 0.0029 0.0005 0.0042
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.1062 0.294 0.2927
Mycobacterium tuberculosis Possible two component system response sensor kinase membrane associated PhoR 0.0033 0.0018 0.0018
Mycobacterium ulcerans two component system response phosphate sensor kinase, PhoR 0.0033 0.0018 0.0018
Trypanosoma cruzi glycerol uptake protein, putative 0.0132 0.0298 0.0778
Toxoplasma gondii DNA topoisomerase 2, putative 0.0248 0.0628 0.0624
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.004 0.0108
Trypanosoma brucei Polypeptide deformylase 1 0.1354 0.3768 1
Onchocerca volvulus 0.0041 0.004 0.0633
Onchocerca volvulus 0.0132 0.0298 0.4744
Plasmodium vivax DNA gyrase subunit B, putative 0.1062 0.294 0.2936
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0072 0.0267
Echinococcus multilocularis sterol O acyltransferase 1 0.0741 0.2029 1
Leishmania major hypothetical protein, conserved 0.0029 0.0005 0.0014
Brugia malayi DNA topoisomerase III 0.0076 0.0139 0.1135
Brugia malayi GRF zinc finger family protein 0.0076 0.0139 0.1135
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0248 0.0628 0.5127
Mycobacterium ulcerans esterase/lipase LipP 0.0041 0.004 0.004
Trypanosoma brucei Heat shock protein 83, putative 0.0033 0.0018 0.0034
Schistosoma mansoni zinc finger protein 0.0132 0.0298 0.1393
Mycobacterium tuberculosis Conserved protein 0.0041 0.004 0.004
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.004 0.0356
Schistosoma mansoni aldehyde dehydrogenase 0.0069 0.012 0.0505
Leishmania major glycerol uptake protein, putative 0.0132 0.0298 0.0791
Leishmania major glycerol uptake protein, putative 0.0132 0.0298 0.0791
Entamoeba histolytica heat shock protein 90, putative 0.0033 0.0018 0.0287
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0018 0.0013
Toxoplasma gondii aldehyde dehydrogenase 0.0069 0.012 0.0115
Trypanosoma cruzi DNA topoisomerase IA, putative 0.0076 0.0139 0.0356
Trypanosoma cruzi heat shock protein 90, putative 0.0033 0.0018 0.0034
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0172 0.0413 0.1083
Trichomonas vaginalis penicillin-binding protein, putative 0.0041 0.004 0.0356
Mycobacterium tuberculosis Probable two component sensor kinase 0.0033 0.0018 0.0018
Mycobacterium leprae conserved hypothetical protein 0.0041 0.004 0.004
Schistosoma mansoni sterol O-acyltransferase 1 0.0741 0.2029 1
Brugia malayi Probable DNA topoisomerase II 0.0248 0.0628 0.5127
Trypanosoma cruzi DNA topoisomerase II, putative 0.0172 0.0413 0.1083
Treponema pallidum polypeptide deformylase (def) 0.3547 1 1
Trypanosoma cruzi DNA topoisomerase III, putative 0.0076 0.0139 0.0356
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Mycobacterium ulcerans two component system membrane associated sensor kinase 0.0033 0.0018 0.0018
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.1062 0.294 0.294
Mycobacterium tuberculosis Probable sensor protein KdpD 0.0033 0.0018 0.0018
Plasmodium vivax hypothetical protein, conserved 0.0041 0.004 0.0035
Mycobacterium leprae Probable lipase LipE 0.0041 0.004 0.004
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0132 0.0298 0.1393
Brugia malayi MBOAT family protein 0.0132 0.0298 0.2432
Leishmania major glycerol uptake protein, putative 0.0132 0.0298 0.0791
Mycobacterium leprae Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0366 0.0962 0.0962
Plasmodium vivax endoplasmin, putative 0.0033 0.0018 0.0013
Mycobacterium ulcerans two component sensor histidine kinase TrcS 0.0033 0.0018 0.0018
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.0072 0.0585
Brugia malayi Hhat protein 0.0132 0.0298 0.2432
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Trypanosoma cruzi DNA topoisomerase III, putative 0.0076 0.0139 0.0356
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0132 0.0298 0.1393
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.004 0.0108
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.004 0.0108
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0132 0.0298 0.1393
Echinococcus granulosus muscleblind protein 0.017 0.0406 0.1931
Trypanosoma cruzi GUP1, putative 0.0132 0.0298 0.0778
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Trypanosoma brucei hypothetical protein, conserved 0.0041 0.004 0.0092
Leishmania major hypothetical protein, conserved 0.0132 0.0298 0.0791
Mycobacterium tuberculosis Two component sensor kinase [second part] 0.0033 0.0018 0.0018
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0076 0.0139 0.0602
Trypanosoma cruzi heat shock protein 90, putative 0.0033 0.0018 0.0034
Trypanosoma brucei glycerol uptake protein, putative 0.0132 0.0298 0.0778
Trypanosoma cruzi Peptide deformylase 2, putative 0.1354 0.3768 1
Mycobacterium tuberculosis Conserved protein 0.0033 0.0018 0.0018
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0072 0.0267
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0132 0.0298 0.1393
Brugia malayi diacylglycerol acyltransferase 0.0458 0.1225 1
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0132 0.0298 0.1393
Echinococcus multilocularis muscleblind protein 0.017 0.0406 0.1931
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0069 0.012 0.0505
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0076 0.0139 0.1983
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0033 0.0018 0.0018
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0458 0.1225 0.6004
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0033 0.0018 0.0018
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0033 0.0018 0.0013
Plasmodium falciparum DNA topoisomerase 3, putative 0.0076 0.0139 0.0134
Trichomonas vaginalis conserved hypothetical protein 0.0132 0.0298 0.4589
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0132 0.0298 0.4744
Entamoeba histolytica heat shock protein 90, putative 0.0033 0.0018 0.0287
Loa Loa (eye worm) hhat protein 0.0132 0.0298 0.1469
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.3547 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.004 0.0356
Trichomonas vaginalis D-aminoacylase, putative 0.0041 0.004 0.0356
Mycobacterium ulcerans DNA gyrase subunit B 0.1062 0.294 0.294
Toxoplasma gondii ABC1 family protein 0.0041 0.004 0.0035
Mycobacterium ulcerans aldehyde dehydrogenase 0.0069 0.012 0.012
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0248 0.0628 1
Mycobacterium tuberculosis Conserved protein 0.0041 0.004 0.004
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0132 0.0298 0.1393
Chlamydia trachomatis DNA topoisomerase I 0.0076 0.0139 0.0121
Mycobacterium tuberculosis Two component sensory transduction histidine kinase MtrB 0.0033 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.0609 0.1654 0.8153
Mycobacterium tuberculosis Probable lipase LipE 0.0041 0.004 0.004
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.004 0.0092
Mycobacterium ulcerans putative regultory protein 0.0033 0.0018 0.0018
Loa Loa (eye worm) hypothetical protein 0.017 0.0406 0.2002
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0248 0.0628 1
Brugia malayi MBOAT family protein 0.0132 0.0298 0.2432
Brugia malayi beta-lactamase family protein 0.0041 0.004 0.0324
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0132 0.0298 0.1393
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Loa Loa (eye worm) hypothetical protein 0.0132 0.0298 0.1469
Echinococcus granulosus o acyltransferase membrane bound domain 0.0132 0.0298 0.1393
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Leishmania major DNA topoisomerase III, putative 0.0076 0.0139 0.0369
Trypanosoma brucei DNA topoisomerase IA, putative 0.0076 0.0139 0.0356
Chlamydia trachomatis DNA gyrase subunit B 0.0696 0.1901 0.1887
Trichomonas vaginalis transmembrane protein nessy, putative 0.0132 0.0298 0.4589
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0248 0.0628 1
Mycobacterium ulcerans beta-lactamase 0.0041 0.004 0.004
Entamoeba histolytica hypothetical protein, conserved 0.0132 0.0298 0.4744
Mycobacterium ulcerans hypothetical protein 0.0041 0.004 0.004
Echinococcus multilocularis DNA topoisomerase 3 beta 1 0.0076 0.0139 0.0602
Mycobacterium ulcerans two component sensor histidine kinase PrrB 0.0033 0.0018 0.0018
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0069 0.012 0.0317
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0041 0.004 0.004
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Brugia malayi Muscleblind-like protein 0.017 0.0406 0.3315
Trypanosoma brucei DNA topoisomerase III, putative 0.0076 0.0139 0.0356
Trichomonas vaginalis esterase, putative 0.0041 0.004 0.0356
Loa Loa (eye worm) MBOAT family protein 0.0132 0.0298 0.1469
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0132 0.0298 0.1393
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0132 0.0298 0.4744
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trichomonas vaginalis conserved hypothetical protein 0.0132 0.0298 0.4589
Brugia malayi kinase, mitochondrial precursor 0.0033 0.0018 0.0147
Trypanosoma cruzi Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0033 0.0018 0.0034
Mycobacterium tuberculosis Possible two component sensor kinase TcrY 0.0033 0.0018 0.0018
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0172 0.0413 0.1083
Plasmodium vivax peptide deformylase, putative 0.3547 1 1
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.3547 1 1
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Plasmodium falciparum peptide deformylase 0.3547 1 1
Mycobacterium tuberculosis Possible two component sensor kinase 0.0033 0.0018 0.0018
Trypanosoma cruzi heat shock protein 85, putative 0.0033 0.0018 0.0034
Loa Loa (eye worm) hypothetical protein 0.0041 0.004 0.0196
Trypanosoma brucei Peptide deformylase 2 0.1354 0.3768 1
Treponema pallidum alginate O-acetylation protein (algI) 0.0132 0.0298 0.0281
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trypanosoma cruzi glycerol uptake protein, putative 0.0132 0.0298 0.0778
Mycobacterium leprae TWO COMPONENT SENSOR HISTIDINE KINASE PRRB 0.0033 0.0018 0.0018
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Mycobacterium leprae Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) ( 0.0076 0.0139 0.0139
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.1062 0.294 0.2927
Brugia malayi MBOAT family protein 0.0132 0.0298 0.2432
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0458 0.1225 0.6004
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0262 0.0667 0.0667
Toxoplasma gondii hypothetical protein 0.3547 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0041 0.004 0.0092
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0614 0.1667 0.4416
Onchocerca volvulus 0.0076 0.0139 0.2213
Leishmania major hypothetical protein, conserved 0.0033 0.0018 0.0048
Loa Loa (eye worm) hypothetical protein 0.0326 0.0851 0.4193
Echinococcus granulosus sterol O acyltransferase 1 0.0741 0.2029 1
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0458 0.1225 0.1221
Mycobacterium ulcerans peptide deformylase 0.3547 1 1
Wolbachia endosymbiont of Brugia malayi topoisomerase IA, TopA 0.0076 0.0139 0.0121
Trichomonas vaginalis porcupine, putative 0.0132 0.0298 0.4589
Loa Loa (eye worm) hypothetical protein 0.0132 0.0298 0.1469
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trypanosoma brucei DNA topoisomerase ii 0.0614 0.1667 0.4416
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Mycobacterium ulcerans sensor kinase from two component regulatory system 0.0033 0.0018 0.0018
Onchocerca volvulus 0.0041 0.004 0.0633
Entamoeba histolytica DNA topoisomerase III, putative 0.0076 0.0139 0.2213
Brugia malayi Endoplasmin precursor 0.0033 0.0018 0.0147
Brugia malayi beta-lactamase 0.0041 0.004 0.0324
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Mycobacterium tuberculosis Probable esterase LipL 0.0041 0.004 0.004
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0072 0.0267
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Mycobacterium tuberculosis Two component sensor histidine kinase PrrB 0.0033 0.0018 0.0018
Toxoplasma gondii heat shock protein 90, putative 0.0033 0.0018 0.0013
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0033 0.0018 0.0018
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.004 0.0108
Loa Loa (eye worm) hypothetical protein 0.0033 0.0018 0.0089
Loa Loa (eye worm) MBOAT family protein 0.0132 0.0298 0.1469
Leishmania major glycerol uptake protein, putative 0.0132 0.0298 0.0791
Toxoplasma gondii DNA topoisomerase family protein 0.0076 0.0139 0.0134
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.3547 1 1
Brugia malayi beta-lactamase family protein 0.0041 0.004 0.0324
Toxoplasma gondii heat shock protein HSP90 0.0033 0.0018 0.0013
Trypanosoma cruzi heat shock protein 85, putative 0.0033 0.0018 0.0034
Loa Loa (eye worm) DNA topoisomerase III beta-1 0.0076 0.0139 0.0685
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0132 0.0298 0.1393
Plasmodium falciparum DNA topoisomerase 2 0.0248 0.0628 0.0624
Giardia lamblia DNA topoisomerase II 0.0215 0.0534 1
Trypanosoma cruzi DNA topoisomerase II, putative 0.0172 0.0413 0.1083
Leishmania major DNA topoisomerase ii 0.0172 0.0413 0.1095
Echinococcus multilocularis rho GTPase activating protein 20 0.0076 0.0139 0.0602
Plasmodium falciparum DNA gyrase subunit B 0.1062 0.294 0.2936
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.004 0.0196
Plasmodium vivax DNA topoisomerase II, putative 0.0248 0.0628 0.0624
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.0076 0.0139 0.0134
Plasmodium falciparum heat shock protein 90 0.0033 0.0018 0.0013
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0248 0.0628 0.3035
Mycobacterium tuberculosis Two component sensor histidine kinase TrcS 0.0033 0.0018 0.0018
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0458 0.1225 0.1221
Chlamydia trachomatis DNA gyrase subunit B 0.1062 0.294 0.2927
Mycobacterium ulcerans lipase LipD 0.0041 0.004 0.004
Schistosoma mansoni prokaryotic DNA topoisomerase 0.0076 0.0139 0.0602
Loa Loa (eye worm) hypothetical protein 0.0172 0.0413 0.2034
Trypanosoma brucei heat shock protein, putative 0.0033 0.0018 0.0034
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0458 0.1225 0.6004
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0041 0.004 0.004
Mycobacterium ulcerans two component regulator - sensor kinase 0.0033 0.0018 0.0018
Trichomonas vaginalis prokaryotic DNA topoisomerase, putative 0.0076 0.0139 0.1983
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0614 0.1667 0.4416
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0072 0.0267
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0132 0.0298 0.1393
Mycobacterium tuberculosis Conserved protein 0.0041 0.004 0.004
Mycobacterium ulcerans two component sensor histidine kinase SenX3 0.0033 0.0018 0.0018
Mycobacterium ulcerans two component sensory transduction histidine kinase MtrB 0.0033 0.0018 0.0018
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0132 0.0298 0.4744
Leishmania major heat shock protein 83-1 0.0033 0.0018 0.0048
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0458 0.1225 0.1221

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 20 uM Antiplasmodial activity against chloroquine- and pyrimethamine-resistant Plasmodium falciparum K1 infected in human red blood cells assessed as [3H]hypoxanthine incorporation after 48 hrs by liquid scintillation counting ChEMBL. 21438586
IC50 (functional) = 38.2 uM Antiparasitic activity against Trypanosoma brucei rhodesiense STIB 900 bloodstream form after 72 hrs by microplate fluorimetry ChEMBL. 21438586

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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