Detailed information for compound 1473350

Basic information

Technical information
  • TDR Targets ID: 1473350
  • Name: 3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-ox ohexyl]-1H-quinazoline-2,4-dione
  • MW: 450.53 | Formula: C25H30N4O4
  • H donors: 1 H acceptors: 3 LogP: 2.69 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc(c1)N1CCN(CC1)C(=O)CCCCCn1c(=O)[nH]c2c(c1=O)cccc2
  • InChi: 1S/C25H30N4O4/c1-33-20-9-7-8-19(18-20)27-14-16-28(17-15-27)23(30)12-3-2-6-13-29-24(31)21-10-4-5-11-22(21)26-25(29)32/h4-5,7-11,18H,2-3,6,12-17H2,1H3,(H,26,32)
  • InChiKey: HPVCHLPOBCTNHH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-[6-[4-(3-methoxyphenyl)piperazin-1-yl]-6-oxo-hexyl]-1H-quinazoline-2,4-dione
  • 3-[6-[4-(3-methoxyphenyl)-1-piperazinyl]-6-oxohexyl]-1H-quinazoline-2,4-dione
  • 3-[6-keto-6-[4-(3-methoxyphenyl)piperazin-1-yl]hexyl]-1H-quinazoline-2,4-quinone
  • K221-2486
  • NCGC00138146-01
  • EU-0093763

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Bacillus subtilis (strain 168) ATP-dependent Clp protease proteolytic subunit Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) Get druggable targets OG5_127187 All targets in OG5_127187
Theileria parva ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Plasmodium yoelii ATP-dependent Clp protease, proteolytic subunit ClpP, putative Get druggable targets OG5_127187 All targets in OG5_127187
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma japonicum ko:K01358 ATP-dependent Clp protease, protease subunit [EC3.4.21.92], putative Get druggable targets OG5_127187 All targets in OG5_127187
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Brugia malayi Probable ClpP-like protease Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus granulosus peptidase Clp S14 family Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) Get druggable targets OG5_127187 All targets in OG5_127187
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Theileria parva ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Babesia bovis ATP-dependent Clp protease proteolytic subunit 1, putative Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium knowlesi ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus multilocularis peptidase Clp (S14 family) Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Plasmodium berghei ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma mansoni peptidase Clp (S14 family) Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative Get druggable targets OG5_127187 All targets in OG5_127187
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Treponema pallidum ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Neospora caninum ATP-dependent Clp protease proteolytic subunit, related Get druggable targets OG5_127187 All targets in OG5_127187
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit Get druggable targets OG5_127187 All targets in OG5_127187
Schistosoma japonicum ko:K06275 parvin, putative Get druggable targets OG5_127187 All targets in OG5_127187
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium berghei ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 180 aa 36.7 %
Onchocerca volvulus Putative V-type proton ATPase subunit F ATP-dependent Clp protease proteolytic subunit   197 aa 194 aa 54.1 %
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit ATP-dependent Clp protease proteolytic subunit   197 aa 183 aa 36.1 %
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 ATP-dependent Clp protease proteolytic subunit   197 aa 172 aa 57.0 %
Babesia bovis ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 188 aa 41.5 %
Plasmodium yoelii Clp protease ATP-dependent Clp protease proteolytic subunit   197 aa 183 aa 36.6 %
Chlamydia trachomatis hypothetical protein ATP-dependent Clp protease proteolytic subunit   197 aa 171 aa 22.8 %
Plasmodium knowlesi ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 189 aa 36.0 %
Babesia bovis ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 188 aa 41.5 %
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative ATP-dependent Clp protease proteolytic subunit   197 aa 189 aa 35.5 %
Schistosoma mansoni neuropeptide receptor ATP-dependent Clp protease proteolytic subunit   197 aa 174 aa 20.1 %
Treponema pallidum ATP-dependent Clp protease proteolytic subunit ATP-dependent Clp protease proteolytic subunit   197 aa 186 aa 40.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.077 0.1229
Brugia malayi Probable ClpP-like protease 0.0094 0.0814 0.1298
Brugia malayi RNA binding protein 0.0124 0.1187 0.1894
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Mycobacterium leprae Probable lipase LipE 0.0036 0.0081 0.0481
Echinococcus granulosus intermediate filament protein 0.0054 0.0312 0.0233
Brugia malayi Inositol-1 0.0036 0.0092 0.0147
Schistosoma mansoni hypothetical protein 0.0049 0.0252 0.0199
Echinococcus multilocularis tar DNA binding protein 0.0124 0.1187 0.1115
Schistosoma mansoni inositol monophosphatase 0.0036 0.0092 0.0038
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0062 0.0409 0.151
Brugia malayi Importin beta-1 subunit 0.0058 0.0365 0.0582
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0043 0.0173 0.0207
Loa Loa (eye worm) hypothetical protein 0.0031 0.0021 0.0028
Loa Loa (eye worm) macrophage migration inhibitory factor 2 0.0248 0.272 0.3685
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 0.1236
Leishmania major macrophage migration inhibitory factor-like protein 0.0533 0.627 1
Trichomonas vaginalis macrophage migration inhibitory factor, mif, putative 0.0533 0.627 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0623 0.738 1
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0054 0.0086
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0043 0.0173 0.3249
Schistosoma mansoni hypothetical protein 0.0623 0.738 0.7366
Loa Loa (eye worm) beta-lactamase 0.0036 0.0081 0.011
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0.0365 1
Loa Loa (eye worm) macrophage migration inhibitory factor 0.0533 0.627 0.8495
Echinococcus multilocularis geminin 0.0506 0.5931 0.5898
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0094 0.0814 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.0062 0.0409 0.0331
Leishmania major importin beta-1 subunit, putative 0.0047 0.0228 0.0237
Toxoplasma gondii ABC1 family protein 0.0036 0.0081 0.0059
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0094 0.0814 0.0739
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0259 0.0288
Brugia malayi follicle stimulating hormone receptor 0.0227 0.2456 0.3917
Loa Loa (eye worm) hypothetical protein 0.0031 0.0021 0.0028
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.005 0.0259 1
Brugia malayi MAP kinase sur-1 0.005 0.0259 0.0413
Echinococcus multilocularis lamin dm0 0.0054 0.0312 0.0233
Loa Loa (eye worm) inositol-1 0.0036 0.0092 0.0125
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0081 0.0481
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0092 0.0017
Schistosoma mansoni tar DNA-binding protein 0.0124 0.1187 0.114
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Schistosoma mansoni ran 0.0043 0.0173 0.012
Trichomonas vaginalis ran, putative 0.0043 0.0173 0.0149
Echinococcus granulosus snurportin 1 0.0623 0.738 0.7359
Echinococcus granulosus geminin 0.0506 0.5931 0.5898
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0081 0.0027
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0259 0.0288
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 0.5
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0081 0.0152
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.077 0.072
Mycobacterium tuberculosis Conserved protein 0.0036 0.0081 0.0152
Giardia lamblia Macrophage migration inhibitory factor 0.0533 0.627 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.0252 0.0402
Loa Loa (eye worm) thyroglobulin type-1 repeat family protein 0.0031 0.0021 0.0028
Schistosoma mansoni serine/threonine protein kinase 0.005 0.0259 0.0206
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0092 0.0604
Loa Loa (eye worm) hypothetical protein 0.0054 0.0312 0.0423
Entamoeba histolytica macrophage migration inhibitory factor-like protein 0.0533 0.627 1
Echinococcus granulosus lamin dm0 0.0054 0.0312 0.0233
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 1
Leishmania major GTP-binding protein, putative 0.0043 0.0173 0.0149
Schistosoma mansoni lamin 0.0054 0.0312 0.026
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0246 0.0392
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0081 0.0027
Loa Loa (eye worm) hypothetical protein 0.0125 0.1195 0.1619
Brugia malayi intermediate filament protein 0.0054 0.0312 0.0498
Toxoplasma gondii macrophage migration inhibitory factor, putative 0.0533 0.627 1
Echinococcus multilocularis musashi 0.0054 0.0312 0.0233
Plasmodium vivax macrophage migration inhibitory factor, putative 0.0533 0.627 1
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Trypanosoma brucei protein kinase, putative 0.005 0.0259 0.6278
Echinococcus multilocularis mitogen activated protein kinase 3 0.005 0.0259 0.0179
Onchocerca volvulus 0.0049 0.0252 0.1971
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0094 0.0814 0.1236
Schistosoma mansoni hypothetical protein 0.0506 0.5931 0.5909
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0043 0.0173 0.0277
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0092 0.0604
Echinococcus multilocularis survival motor neuron protein 1 0.0241 0.2642 0.2581
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.077 0.072
Loa Loa (eye worm) RNA binding protein 0.0124 0.1187 0.1609
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0081 0.0152
Schistosoma mansoni importin beta-1 0.0058 0.0365 0.0312
Brugia malayi beta-lactamase family protein 0.0036 0.0081 0.013
Trypanosoma cruzi importin beta-1 subunit, putative 0.0047 0.0228 0.8226
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.077 0.0695
Brugia malayi Intermediate filament tail domain containing protein 0.0054 0.0312 0.0498
Mycobacterium tuberculosis Conserved protein 0.0036 0.0081 0.0152
Mycobacterium tuberculosis Conserved protein 0.0036 0.0081 0.0152
Onchocerca volvulus Huntingtin homolog 0.0125 0.1195 1
Schistosoma mansoni survival motor neuron protein 0.0049 0.0252 0.0199
Echinococcus granulosus peptidase Clp S14 family 0.0062 0.0409 0.0331
Plasmodium falciparum importin beta, putative 0.0058 0.0365 0.0515
Echinococcus granulosus lamin 0.0054 0.0312 0.0233
Brugia malayi Thyroglobulin type-1 repeat family protein 0.0031 0.0021 0.0033
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.005 0.0259 0.0351
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0043 0.0173 0.0093
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0173 0.5176
Plasmodium vivax importin-beta 2, putative 0.0058 0.0365 0.0515
Trichomonas vaginalis importin beta-1, putative 0.0047 0.0228 0.0237
Schistosoma mansoni hypothetical protein 0.0506 0.5931 0.5909
Echinococcus multilocularis mitogen activated protein kinase 0.005 0.0259 0.0179
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0062 0.0409 0.151
Toxoplasma gondii HEAT repeat-containing protein 0.0058 0.0365 0.0515
Schistosoma mansoni ran 0.0043 0.0173 0.012
Schistosoma mansoni tar DNA-binding protein 0.0124 0.1187 0.114
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0092 0.0147
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0081 0.0152
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0227 0.246 1
Onchocerca volvulus 0.0036 0.0081 0.0516
Loa Loa (eye worm) intermediate filament protein 0.0054 0.0312 0.0423
Schistosoma mansoni tar DNA-binding protein 0.0124 0.1187 0.114
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0173 0.5176
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.1187 0.1894
Loa Loa (eye worm) hypothetical protein 0.0033 0.0054 0.0073
Echinococcus multilocularis snurportin 1 0.0623 0.738 0.7359
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0036 0.0092 0.0077
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0259 0.0288
Brugia malayi TAR-binding protein 0.0124 0.1187 0.1894
Echinococcus granulosus mitogen activated protein kinase 0.005 0.0259 0.0179
Loa Loa (eye worm) hypothetical protein 0.0241 0.2642 0.3579
Loa Loa (eye worm) hypothetical protein 0.0053 0.03 0.0406
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0246 0.0333
Onchocerca volvulus 0.0036 0.0081 0.0516
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0259 0.0288
Schistosoma mansoni intermediate filament proteins 0.0054 0.0312 0.026
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0081 0.0152
Schistosoma mansoni tar DNA-binding protein 0.0124 0.1187 0.114
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0043 0.0173 0.0207
Brugia malayi Bm-MIF-1, identical 0.0533 0.627 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Echinococcus multilocularis lamin 0.0054 0.0312 0.0233
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0092 0.0017
Entamoeba histolytica hypothetical protein 0.0047 0.0228 0.022
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0036 0.0092 0.0379
Echinococcus granulosus GTP binding nuclear protein Ran 0.0043 0.0173 0.0093
Loa Loa (eye worm) TAR-binding protein 0.0124 0.1187 0.1609
Echinococcus multilocularis importin subunit beta 1 0.0058 0.0365 0.0286
Loa Loa (eye worm) macrophage migration inhibitory factor 2 0.0248 0.272 0.3685
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0062 0.0409 0.4744
Brugia malayi hypothetical protein 0.0125 0.1195 0.1906
Trichomonas vaginalis inositol monophosphatase, putative 0.0036 0.0092 0.0017
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0054 0.0312 0.0423
Loa Loa (eye worm) hypothetical protein 0.0094 0.0814 0.1103
Onchocerca volvulus 0.0054 0.0312 0.2484
Brugia malayi hypothetical protein 0.0241 0.2642 0.4213
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.077 0.0695
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0045 0.0005
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.1187 0.1609
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0047 0.0228 0.0237
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0094 0.0814 0.1236
Brugia malayi secreted modular calcium-binding protein 1 0.0031 0.0021 0.0033
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0259 1
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0094 0.0814 0.1236
Schistosoma mansoni tar DNA-binding protein 0.0124 0.1187 0.114
Echinococcus granulosus mitogen activated protein kinase 3 0.005 0.0259 0.0179
Onchocerca volvulus 0.0036 0.0081 0.0516
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0043 0.0173 0.0207
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0246 0.0392
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 1
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.005 0.0259 0.0288
Brugia malayi RNA, U transporter 1 0.0166 0.1702 0.2714
Loa Loa (eye worm) hypothetical protein 0.0058 0.0365 0.0494
Entamoeba histolytica Ran family GTPase 0.0043 0.0173 0.0132
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0043 0.0173 0.0235
Echinococcus granulosus tar DNA binding protein 0.0124 0.1187 0.1115
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0092 0.0011
Onchocerca volvulus 0.0054 0.0312 0.2484
Plasmodium falciparum macrophage migration inhibitory factor 0.0533 0.627 1
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0081 0.011
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.005 0.0259 0.6278
Schistosoma mansoni lamin 0.0054 0.0312 0.026
Brugia malayi Thyroglobulin type-1 repeat family protein 0.0031 0.0021 0.0033
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0081 0.0059
Echinococcus granulosus survival motor neuron protein 1 0.0241 0.2642 0.2581
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 1
Giardia lamblia Kinase, CMGC MAPK 0.005 0.0259 0.0141
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0081 0.013
Brugia malayi beta-lactamase family protein 0.0036 0.0081 0.013
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.005 0.0259 0.0345
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0227 0.2456 0.3327
Loa Loa (eye worm) hypothetical protein 0.0125 0.1195 0.1619
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0036 0.0092 0.0017
Schistosoma mansoni inositol monophosphatase 0.0036 0.0092 0.0038
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0047 0.0228 0.0237
Loa Loa (eye worm) hypothetical protein 0.0049 0.0246 0.0333
Leishmania major macrophage migration inhibitory factor-like protein 0.0533 0.627 1
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0081 0.0152
Trichomonas vaginalis conserved hypothetical protein 0.0533 0.627 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0081 0.0152
Loa Loa (eye worm) hypothetical protein 0.0031 0.0021 0.0028
Onchocerca volvulus Huntingtin homolog 0.0125 0.1195 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.077 0.1044
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.0814 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.077 0.0695
Schistosoma mansoni peptidase Clp (S14 family) 0.0094 0.0814 0.0764
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0259 1
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0094 0.0814 0.0739
Loa Loa (eye worm) hypothetical protein 0.0036 0.0081 0.011
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.005 0.0259 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.077 0.0695
Loa Loa (eye worm) hypothetical protein 0.0031 0.0021 0.0028
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.005 0.0259 0.0288
Echinococcus granulosus importin subunit beta 1 0.0058 0.0365 0.0286
Loa Loa (eye worm) thyroglobulin type-1 repeat family protein 0.0031 0.0021 0.0028
Brugia malayi Thyroglobulin type-1 repeat family protein 0.0031 0.0021 0.0033
Brugia malayi beta-lactamase 0.0036 0.0081 0.013
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0092 0.0011
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0081 0.0152
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.077 0.072
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0.0365 1

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) = 3.9811 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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