Detailed information for compound 1462960

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 397.393 | Formula: C22H18F3N3O
  • H donors: 0 H acceptors: 2 LogP: 5.49 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: FC(c1ccc(cc1)OC(c1ccccc1)CCn1nnc2c1cccc2)(F)F
  • InChi: 1S/C22H18F3N3O/c23-22(24,25)17-10-12-18(13-11-17)29-21(16-6-2-1-3-7-16)14-15-28-20-9-5-4-8-19(20)26-27-28/h1-13,21H,14-15H2
  • InChiKey: WRKQRHJYCSFFSF-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 Iron-sulfur cluster assembly accessory protein 0.0037 0.0036 0.0035
Echinococcus multilocularis expressed conserved protein 0.0071 0.0082 0.0082
Echinococcus multilocularis alpha 1,3 mannosyl glycoprotein 0.0548 0.0719 0.0719
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0031 0.0029 0.0383
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0178 0.0224 0.0224
Plasmodium falciparum diacylglycerol O-acyltransferase 0.1057 0.1399 1
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0016 0.0008 0.0008
Trypanosoma cruzi glycerol uptake protein, putative 0.0178 0.0224 0.093
Mycobacterium ulcerans beta-lactamase 0.0031 0.0029 0.0383
Loa Loa (eye worm) MBOAT family protein 0.0178 0.0224 0.0224
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.1057 0.1399 1
Loa Loa (eye worm) hhat protein 0.0178 0.0224 0.0224
Schistosoma mansoni lipoxygenase 0.0015 0.0007 0.0004
Brugia malayi Glycosylation related protein 12, isoform 0.0186 0.0235 0.0234
Brugia malayi CXXC zinc finger family protein 0.0026 0.0021 0.002
Echinococcus granulosus phd:f box containing protein 0.0014 0.0006 0.0006
Echinococcus granulosus jumonji domain containing 1A 0.0014 0.0006 0.0006
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Echinococcus granulosus lysine specific demethylase 6a 0.0014 0.0006 0.0006
Echinococcus multilocularis musashi 0.0021 0.0014 0.0014
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0053 0.0058 0.0058
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0033 0.003 0.003
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.7494 1 1
Schistosoma mansoni hypothetical protein 0.0031 0.0029 0.0026
Mycobacterium leprae Probable lipase LipE 0.0031 0.0029 0.5
Plasmodium falciparum LCCL domain-containing protein 0.0015 0.0007 0.0009
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.1773 0.2355 0.2353
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.1773 0.2355 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.0003 0.0003
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0077 0.009 0.0087
Toxoplasma gondii hypothetical protein 0.0178 0.0224 0.093
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0017 0.0009 0.0009
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0053 0.0058 0.0058
Brugia malayi MBOAT family protein 0.0178 0.0224 0.0223
Echinococcus multilocularis lysine specific demethylase 6a 0.0014 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0186 0.0235 0.0235
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Trichomonas vaginalis conserved hypothetical protein 0.0284 0.0366 0.5949
Loa Loa (eye worm) hypothetical protein 0.002 0.0014 0.0014
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0053 0.0058 0.0221
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Echinococcus granulosus microtubule associated protein 2 0.0532 0.0697 0.0697
Brugia malayi jmjC domain containing protein 0.0055 0.006 0.0058
Loa Loa (eye worm) jmjC domain-containing protein 0.0014 0.0006 0.0006
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0393 0.0511 0.0509
Echinococcus granulosus lamin dm0 0.0021 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Mycobacterium ulcerans aldehyde dehydrogenase 0.0053 0.0058 0.0959
Echinococcus granulosus o acyltransferase membrane bound domain 0.0178 0.0224 0.0224
Schistosoma mansoni jumonji/arid domain-containing protein 0.0055 0.006 0.0057
Schistosoma mansoni jumonji/arid domain-containing protein 0.0055 0.006 0.0057
Schistosoma mansoni hypothetical protein 0.0031 0.0029 0.0026
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0021 0.0014 0.0014
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0017 0.0009 0.0027
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Trypanosoma cruzi hypothetical protein, conserved 0.0031 0.0029 0.0098
Trichomonas vaginalis transmembrane protein nessy, putative 0.0178 0.0224 0.358
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0012 0.0003 0.0003
Schistosoma mansoni aldehyde dehydrogenase 0.0053 0.0058 0.0055
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.1057 0.1399 0.1397
Brugia malayi intermediate filament protein 0.0021 0.0014 0.0013
Mycobacterium tuberculosis Probable lipase LipD 0.0031 0.0029 0.0783
Entamoeba histolytica hypothetical protein, conserved 0.0178 0.0224 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0053 0.0058 0.1957
Loa Loa (eye worm) hypothetical protein 0.0076 0.0088 0.0088
Schistosoma mansoni sterol O-acyltransferase 1 0.0178 0.0224 0.0221
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0017 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0548 0.0719 0.0719
Echinococcus multilocularis RUN 0.0015 0.0007 0.0007
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0017 0.0009 0.0016
Onchocerca volvulus 0.0026 0.0021 0.0062
Echinococcus granulosus alpha 13 mannosyl glycoprotein 0.0548 0.0719 0.0719
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0178 0.0224 0.0221
Brugia malayi hypothetical protein 0.0015 0.0007 0.0005
Trichomonas vaginalis penicillin-binding protein, putative 0.0031 0.0029 0.0321
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0031 0.0029 0.0783
Schistosoma mansoni rab6-interacting 0.0015 0.0007 0.0004
Schistosoma mansoni patched 1 0.0033 0.003 0.0027
Echinococcus granulosus sterol regulatory element binding protein 0.0033 0.003 0.003
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0053 0.0058 0.0058
Brugia malayi latrophilin 2 splice variant baaae 0.0026 0.0022 0.002
Loa Loa (eye worm) hypothetical protein 0.0178 0.0224 0.0224
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0038 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Trypanosoma cruzi glycerol uptake protein, putative 0.0178 0.0224 0.093
Schistosoma mansoni cpg binding protein 0.0028 0.0023 0.0021
Schistosoma mansoni jumonji domain containing protein 0.0014 0.0006 0.0003
Onchocerca volvulus 0.0031 0.0029 0.0093
Schistosoma mansoni jumonji domain containing protein 0.0053 0.0058 0.0055
Brugia malayi Intermediate filament tail domain containing protein 0.0021 0.0014 0.0013
Leishmania major glycerol uptake protein, putative 0.0178 0.0224 0.093
Echinococcus granulosus JmjC domain containing protein 4 0.0014 0.0006 0.0006
Echinococcus multilocularis lamin dm0 0.0021 0.0014 0.0014
Brugia malayi MBOAT family protein 0.0178 0.0224 0.0223
Echinococcus multilocularis JmjC domain containing protein 4 0.0014 0.0006 0.0006
Plasmodium vivax multidomain scavenger receptor, putative 0.0015 0.0007 0.0009
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0178 0.0224 0.0224
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0031 0.0029 0.0026
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Loa Loa (eye worm) hhat protein 0.0178 0.0224 0.0224
Trichomonas vaginalis conserved hypothetical protein 0.0178 0.0224 0.358
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0178 0.0224 0.0221
Leishmania major glycerol uptake protein, putative 0.0178 0.0224 0.093
Loa Loa (eye worm) hypothetical protein 0.088 0.1162 0.1162
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.1773 0.2355 1
Trypanosoma brucei glycerol uptake protein, putative 0.0178 0.0224 0.093
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0017 0.0009 0.0027
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0017 0.0009 0.0016
Trichomonas vaginalis conserved hypothetical protein 0.0178 0.0224 0.358
Entamoeba histolytica hypothetical protein 0.0178 0.0224 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0007 0.0007
Leishmania major hypothetical protein, unknown function,protein, unknown function 0.0393 0.0511 0.2152
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0178 0.0224 0.0224
Echinococcus granulosus lamin 0.0021 0.0014 0.0014
Brugia malayi jmjC domain containing protein 0.0014 0.0006 0.0004
Schistosoma mansoni survival motor neuron protein 0.0037 0.0036 0.0033
Schistosoma mansoni cpg binding protein 0.0026 0.0021 0.0019
Mycobacterium ulcerans aldehyde dehydrogenase 0.0053 0.0058 0.0959
Echinococcus granulosus sterol O acyltransferase 1 0.0178 0.0224 0.0224
Mycobacterium tuberculosis Probable lipase LipE 0.0031 0.0029 0.0783
Echinococcus granulosus Polycystic kidney disease protein 0.0015 0.0007 0.0007
Schistosoma mansoni hypothetical protein 0.0015 0.0007 0.0004
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0178 0.0224 0.0224
Echinococcus granulosus lipoxygenase domain containing protein 0.0015 0.0007 0.0007
Echinococcus granulosus o acyltransferase membrane bound domain 0.0178 0.0224 0.0224
Schistosoma mansoni diacylglycerol O-acyltransferase 0.0393 0.0511 0.0509
Trichomonas vaginalis penicillin-binding protein, putative 0.0031 0.0029 0.0321
Loa Loa (eye worm) hypothetical protein 0.0014 0.0006 0.0006
Trypanosoma cruzi GUP1, putative 0.0178 0.0224 0.093
Toxoplasma gondii hypothetical protein 0.0182 0.0229 0.0953
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0178 0.0224 0.0221
Loa Loa (eye worm) jmjC domain-containing protein 0.0055 0.006 0.006
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0201 0.0255 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0014 0.0006 0.0006
Schistosoma mansoni lipoxygenase 0.0043 0.0043 0.0041
Schistosoma mansoni alpha-13-mannosyl-glycoprotein beta-1 2-n-acetylglucosaminyltransferase 0.0548 0.0719 0.0717
Echinococcus multilocularis lysine specific demethylase 5A 0.0053 0.0058 0.0058
Echinococcus granulosus lipoxygenase domain containing protein 0.0015 0.0007 0.0007
Loa Loa (eye worm) hypothetical protein 0.004 0.004 0.004
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0038 0.0038 0.0036
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0012 0.0003 0.0003
Toxoplasma gondii aldehyde dehydrogenase 0.0053 0.0058 0.0221
Leishmania major glycerol uptake protein, putative 0.0178 0.0224 0.093
Brugia malayi jmjC domain containing protein 0.0014 0.0006 0.0004
Treponema pallidum alginate O-acetylation protein (algI) 0.0178 0.0224 1
Onchocerca volvulus 0.0031 0.0029 0.0093
Onchocerca volvulus 0.0021 0.0014 0.0032
Echinococcus granulosus intermediate filament protein 0.0021 0.0014 0.0014
Brugia malayi MBOAT family protein 0.0178 0.0224 0.0223
Echinococcus multilocularis protein patched 0.0033 0.003 0.003
Brugia malayi Latrophilin receptor protein 2 0.0012 0.0003 0.0001
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0012 0.0003 0.0003
Schistosoma mansoni zinc finger protein 0.0178 0.0224 0.0221
Leishmania major diacylglycerol acyltransferase, putative 0.1773 0.2355 1
Loa Loa (eye worm) beta-lactamase 0.0031 0.0029 0.0029
Toxoplasma gondii histone lysine methyltransferase SET1 0.0049 0.0053 0.02
Schistosoma mansoni aldehyde dehydrogenase 0.0053 0.0058 0.0055
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0031 0.0029 0.0783
Echinococcus multilocularis microtubule associated protein 2 0.0532 0.0697 0.0697
Echinococcus multilocularis Polycystic kidney disease protein 0.0015 0.0007 0.0007
Toxoplasma gondii dgat2l1-prov protein 0.1773 0.2355 1
Echinococcus granulosus expressed conserved protein 0.0071 0.0082 0.0082
Schistosoma mansoni cpg binding protein 0.0028 0.0023 0.0021
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0031 0.0029 0.0029
Schistosoma mansoni protein phosphatase 2C 0.0014 0.0006 0.0003
Onchocerca volvulus 0.0031 0.0029 0.0093
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0016 0.0008 0.0008
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0178 0.0224 0.0224
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Echinococcus multilocularis cpg binding protein 0.0028 0.0023 0.0023
Schistosoma mansoni phosphatidylserine receptor 0.0014 0.0006 0.0003
Toxoplasma gondii exonuclease III APE 0.0017 0.0009 0.0016
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0031 0.0029 0.0027
Leishmania major glycerol uptake protein, putative 0.0178 0.0224 0.093
Echinococcus multilocularis phd:f box containing protein 0.0014 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0015 0.0007 0.0007
Brugia malayi GNT-I family protein 0.0548 0.0719 0.0718
Echinococcus granulosus Niemann Pick C1 protein 0.0076 0.0088 0.0088
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0017 0.0009 0.5
Echinococcus multilocularis lamin 0.0021 0.0014 0.0014
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0012 0.0003 0.0001
Brugia malayi beta-lactamase family protein 0.0031 0.0029 0.0027
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0178 0.0224 0.0224
Toxoplasma gondii mono- or diacylglycerol acyltransferase 0.0393 0.0511 0.2152
Loa Loa (eye worm) diacylglycerol acyltransferase 0.1773 0.2355 0.2355
Leishmania major hypothetical protein, conserved 0.0031 0.0029 0.0098
Toxoplasma gondii diacylglycerol acyltransferase 0.0393 0.0511 0.2152
Mycobacterium ulcerans lipase LipD 0.0031 0.0029 0.0383
Brugia malayi CHE-14 protein 0.0033 0.003 0.0029
Onchocerca volvulus 0.0178 0.0224 0.0925
Leishmania major hypothetical protein, conserved 0.0178 0.0224 0.093
Loa Loa (eye worm) hypothetical protein 0.0178 0.0224 0.0224
Brugia malayi beta-lactamase 0.0031 0.0029 0.0027
Mycobacterium ulcerans aldehyde dehydrogenase 0.0053 0.0058 0.0959
Loa Loa (eye worm) hypothetical protein 0.7494 1 1
Leishmania major diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Mycobacterium ulcerans hypothetical protein 0.0031 0.0029 0.0383
Loa Loa (eye worm) hypothetical protein 0.0014 0.0006 0.0006
Echinococcus multilocularis Niemann Pick C1 protein 0.0076 0.0088 0.0088
Trypanosoma brucei hypothetical protein, conserved 0.0031 0.0029 0.0098
Loa Loa (eye worm) intermediate filament protein 0.0021 0.0014 0.0014
Trichomonas vaginalis D-aminoacylase, putative 0.0031 0.0029 0.0321
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0055 0.0061 0.0058
Onchocerca volvulus 0.0021 0.0014 0.0032
Loa Loa (eye worm) hypothetical protein 0.0548 0.0719 0.0719
Echinococcus multilocularis Niemann Pick C1 protein 0.0108 0.0131 0.0131
Echinococcus multilocularis sterol O acyltransferase 1 0.0178 0.0224 0.0224
Schistosoma mansoni ap endonuclease 0.0017 0.0009 0.0007
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0178 0.0224 0.0224
Schistosoma mansoni intermediate filament proteins 0.0021 0.0014 0.0012
Brugia malayi Calcitonin receptor-like protein seb-1 0.0038 0.0038 0.0036
Loa Loa (eye worm) MBOAT family protein 0.0178 0.0224 0.0224
Onchocerca volvulus 0.1773 0.2355 1
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.1057 0.1399 0.5933
Trichomonas vaginalis conserved hypothetical protein 0.0178 0.0224 0.358
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0178 0.0224 1
Trichomonas vaginalis esterase, putative 0.0031 0.0029 0.0321
Echinococcus multilocularis protein dispatched 1 0.0037 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0178 0.0224 0.0224
Echinococcus granulosus GPCR family 2 0.0012 0.0003 0.0003
Brugia malayi Niemann-Pick C1 protein precursor 0.0076 0.0088 0.0087
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.1057 0.1399 0.5933
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0178 0.0224 0.0224
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Loa Loa (eye worm) doublecortin family protein 0.0015 0.0007 0.0007
Echinococcus granulosus Protein patched homolog 1 0.0033 0.003 0.003
Brugia malayi jmjC domain containing protein 0.0014 0.0006 0.0004
Echinococcus granulosus beta LACTamase domain containing family member 0.0031 0.0029 0.0029
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0031 0.0029 0.0783
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0015 0.0007 0.0007
Mycobacterium tuberculosis Probable esterase LipL 0.0031 0.0029 0.0783
Echinococcus multilocularis sterol regulatory element binding protein 0.0033 0.003 0.003
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0178 0.0224 0.0221
Schistosoma mansoni hypothetical protein 0.0031 0.0029 0.0026
Trichomonas vaginalis conserved hypothetical protein 0.0033 0.003 0.0345
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0178 0.0224 0.0224
Schistosoma mansoni hypothetical protein 0.0037 0.0036 0.0033
Echinococcus granulosus cpg binding protein 0.0028 0.0023 0.0023
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0043 0.0043 0.0043
Mycobacterium tuberculosis Conserved protein 0.0031 0.0029 0.0783
Loa Loa (eye worm) CXXC zinc finger family protein 0.0026 0.0021 0.0021
Trichomonas vaginalis D-aminoacylase, putative 0.0031 0.0029 0.0321
Loa Loa (eye worm) diacylglycerol acyltransferase 0.1057 0.1399 0.1399
Echinococcus granulosus survival motor neuron protein 1 0.0182 0.023 0.023
Loa Loa (eye worm) hypothetical protein 0.0038 0.0038 0.0038
Schistosoma mansoni polycystin 1-related 0.0015 0.0007 0.0004
Entamoeba histolytica vacuolar protein sorting 26 0.0178 0.0224 1
Brugia malayi jmjC domain containing protein 0.0053 0.0058 0.0056
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0029 0.0165
Mycobacterium tuberculosis Conserved protein 0.0031 0.0029 0.0783
Echinococcus multilocularis GPCR, family 2 0.0012 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0026 0.0022 0.0022
Schistosoma mansoni hypothetical protein 0.0026 0.0022 0.0019
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0178 0.0224 1
Echinococcus granulosus lysine specific demethylase 5A 0.0055 0.006 0.006
Schistosoma mansoni hypothetical protein 0.0393 0.0511 0.0509
Trichomonas vaginalis porcupine, putative 0.0178 0.0224 0.358
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0076 0.0088 0.3659
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.1057 0.1399 0.1399
Loa Loa (eye worm) hypothetical protein 0.0014 0.0006 0.0006
Trypanosoma brucei glycerol uptake protein, putative 0.0178 0.0224 0.093
Schistosoma mansoni lamin 0.0021 0.0014 0.0012
Mycobacterium ulcerans hypothetical protein 0.0393 0.0511 1
Trypanosoma cruzi glycerol uptake protein, putative 0.0178 0.0224 0.093
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.1057 0.1399 0.1399
Brugia malayi Hhat protein 0.0178 0.0224 0.0223
Mycobacterium ulcerans esterase/lipase LipP 0.0031 0.0029 0.0383
Leishmania major diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Toxoplasma gondii Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase 0.0186 0.0235 0.0977
Loa Loa (eye worm) hypothetical protein 0.0021 0.0014 0.0014
Loa Loa (eye worm) hypothetical protein 0.0182 0.023 0.023
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0043 0.0043 0.0043
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0014 0.0006 0.0003
Schistosoma mansoni loxhd1 0.0015 0.0007 0.0004
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0011 0.0001 0.0001
Trypanosoma cruzi GUP1, putative 0.0178 0.0224 0.093
Echinococcus granulosus Niemann Pick C1 protein 0.0108 0.0131 0.0131
Brugia malayi MBOAT family protein 0.0178 0.0224 0.0223
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Mycobacterium tuberculosis Probable hydrolase 0.0031 0.0029 0.0783
Loa Loa (eye worm) hypothetical protein 0.0178 0.0224 0.0224
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.7494 1 1
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Schistosoma mansoni lamin 0.0021 0.0014 0.0012
Brugia malayi Doublecortin family protein 0.0015 0.0007 0.0005
Loa Loa (eye worm) MBOAT family protein 0.0178 0.0224 0.0224
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0017 0.0009 0.0009
Brugia malayi hypothetical protein 0.0015 0.0007 0.0005
Brugia malayi diacylglycerol acyltransferase 0.1057 0.1399 0.1398
Trypanosoma cruzi hypothetical protein, conserved 0.0031 0.0029 0.0098
Echinococcus multilocularis lipoxygenase domain containing protein 0.0015 0.0007 0.0007
Onchocerca volvulus 0.0037 0.0036 0.0125
Loa Loa (eye worm) hypothetical protein 0.0033 0.003 0.003
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0031 0.0029 0.0026
Brugia malayi jmjC domain containing protein 0.0014 0.0006 0.0004
Trypanosoma brucei diacylglycerol acyltransferase, putative 0.1773 0.2355 1
Mycobacterium tuberculosis Conserved protein 0.0031 0.0029 0.0783
Schistosoma mansoni hypothetical protein 0.0178 0.0224 0.0221
Toxoplasma gondii ABC1 family protein 0.0031 0.0029 0.0098
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0178 0.0224 0.0221
Schistosoma mansoni phd/f-box containing protein 0.0014 0.0006 0.0003
Echinococcus multilocularis jumonji domain containing 1A 0.0014 0.0006 0.0006
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Schistosoma mansoni microtubule-associated protein tau 0.0532 0.0697 0.0694
Brugia malayi diacylglycerol acyltransferase family protein 0.1773 0.2355 0.2354
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0178 0.0224 0.0224
Brugia malayi MBOAT family protein 0.0178 0.0224 0.0223
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0178 0.0224 0.0224
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0053 0.0058 0.0058
Leishmania major glycerol uptake protein, putative 0.0178 0.0224 0.093
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0012 0.0003 0.0003
Brugia malayi hypothetical protein 0.0182 0.023 0.0229
Echinococcus multilocularis beta LACTamase domain containing family member 0.0031 0.0029 0.0029
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0178 0.0224 1
Trichomonas vaginalis D-aminoacylase, putative 0.0031 0.0029 0.0321
Loa Loa (eye worm) jmjC domain-containing protein 0.0014 0.0006 0.0006
Brugia malayi beta-lactamase family protein 0.0031 0.0029 0.0027
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0178 0.0224 0.0224
Echinococcus granulosus RUN 0.0015 0.0007 0.0007
Mycobacterium leprae conserved hypothetical protein 0.0031 0.0029 0.5
Echinococcus granulosus o acyltransferase membrane bound domain 0.0178 0.0224 0.0224
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0012 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0031 0.0029 0.0029
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.7494 1 1
Brugia malayi exodeoxyribonuclease III family protein 0.0017 0.0009 0.0008
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0017 0.0009 0.0016
Schistosoma mansoni ap endonuclease 0.0017 0.0009 0.0007
Echinococcus multilocularis survival motor neuron protein 1 0.0182 0.023 0.023
Trypanosoma cruzi diacylglycerol acyltransferase, putative 0.0393 0.0511 0.2152
Trichomonas vaginalis conserved hypothetical protein 0.0466 0.0609 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0017 0.0009 0.5
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0017 0.0009 0.0016
Schistosoma mansoni rab6-interacting 0.0015 0.0007 0.0004
Schistosoma mansoni hypothetical protein 0.0031 0.0029 0.0026

Activities

Activity type Activity value Assay description Source Reference
MIC (functional) > 50 ug ml-1 Antifungal activity against Candida albicans after 48 hrs by broth microdilution assay ChEMBL. 21130651
MIC (functional) > 50 ug ml-1 Antifungal activity against Candida albicans MTCC-183 after 48 hrs by broth microdilution assay ChEMBL. 21130651
MIC (functional) > 50 ug ml-1 Antifungal activity against Candida albicans isolate CDRI after 48 hrs by broth microdilution assay ChEMBL. 21130651
MIC (functional) > 50 ug ml-1 Antifungal activity against Candida albicans NCIM-3557 after 48 hrs by broth microdilution assay ChEMBL. 21130651
MIC (functional) > 200 ug ml-1 Antitrichomonas activity against Trichomonas vaginalis after 48 hrs by trypan blue exclusion assay ChEMBL. 21130651

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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