Detailed information for compound 607624

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 575.362 | Formula: C21H22IN9O3
  • H donors: 3 H acceptors: 6 LogP: 4.19 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: CN1CCN(CC1)c1nc(N/N=C/c2cc(I)ccc2O)nc(n1)Nc1ccc(cc1)[N+](=O)[O-]
  • InChi: 1S/C21H22IN9O3/c1-29-8-10-30(11-9-29)21-26-19(24-16-3-5-17(6-4-16)31(33)34)25-20(27-21)28-23-13-14-12-15(22)2-7-18(14)32/h2-7,12-13,32H,8-11H2,1H3,(H2,24,25,26,27,28)/b23-13+
  • InChiKey: RPBJMJLBJAAJOW-YDZHTSKRSA-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
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0482 0.0451
Echinococcus multilocularis intestinal type alkaline phosphatase 1 0.0174 0.2209 0.2163
Echinococcus granulosus jumonji domain containing 1A 0.0027 0.0178 0.0119
Entamoeba histolytica fatty acid elongase, putative 0.0044 0.0415 0.0995
Echinococcus multilocularis RUN 0.0021 0.0098 0.004
Toxoplasma gondii PUL domain-containing protein 0.0039 0.0339 0.3802
Chlamydia trachomatis oxoacyl-ACP synthase III 0.034 0.4493 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0313 0.4124 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0237 0.0783
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0165 0.2086 0.2039
Brugia malayi PHD-finger family protein 0.0028 0.0199 0.0656
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0077 0.0873 0.0819
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0406 0.0349
Plasmodium vivax hypothetical protein, conserved 0.0039 0.0339 0.0725
Leishmania major mitochondrial DNA polymerase beta 0.0324 0.4268 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.0341 0.0814
Schistosoma mansoni hypothetical protein 0.0074 0.0826 0.0796
Echinococcus granulosus peptidase Clp S14 family 0.0051 0.0506 0.045
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0482 0.0426
Schistosoma mansoni hypothetical protein 0.0034 0.0279 0.0247
Echinococcus granulosus intestinal type alkaline phosphatase 1 0.0174 0.2209 0.2163
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0066 0.0713 0.0658
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0098 0.004
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0231 0.0762
Leishmania major alpha glucosidase II subunit, putative 0.0039 0.0341 0.0786
Mycobacterium tuberculosis Conserved hypothetical protein 0.017 0.2157 0.4376
Leishmania major hypothetical protein, conserved 0.0039 0.0339 0.0781
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0019 0.0068 0.0035
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0098 0.004
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0031 0.023 0.0172
Giardia lamblia Fructose-bisphosphate aldolase 0.0313 0.4124 1
Loa Loa (eye worm) doublecortin family protein 0.0021 0.0098 0.0324
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0406 0.0349
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0039 0.0341 0.1124
Mycobacterium ulcerans beta-ketoacyl synthase-like protein 0.034 0.4493 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0108 0.1298 0.4282
Loa Loa (eye worm) hypothetical protein 0.016 0.2013 0.6642
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0039 0.0341 0.3822
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0434 0.1005
Brugia malayi Bromodomain containing protein 0.0082 0.0939 0.3097
Brugia malayi Latrophilin receptor protein 2 0.0034 0.0279 0.0919
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0098 0.004
Echinococcus multilocularis neuropeptide receptor A26 0.0495 0.6637 0.6618
Brugia malayi Glycosyl hydrolases family 31 protein 0.0039 0.0341 0.1124
Echinococcus granulosus fetal alzheimer antigen falz 0.0026 0.0164 0.0106
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0077 0.0873 1
Echinococcus multilocularis cpg binding protein 0.0035 0.0283 0.0226
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0031 0.023 0.0172
Brugia malayi Probable ClpP-like protease 0.0077 0.0873 0.2881
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0153 0.1916 1
Echinococcus granulosus alkaline phosphatase 0.0174 0.2209 0.2163
Schistosoma mansoni peptidase Clp (S14 family) 0.0077 0.0873 0.0843
Onchocerca volvulus 0.0031 0.0231 0.1889
Plasmodium falciparum phd finger protein, putative 0.0031 0.0237 0.0366
Echinococcus granulosus phd:f box containing protein 0.0027 0.0178 0.0119
Schistosoma mansoni alkaline phosphatase 0.0174 0.2209 0.2183
Echinococcus multilocularis zinc finger protein 0.0023 0.012 0.0062
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.0112 0.0368
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0018 0.0053 0.002
Treponema pallidum fructose-bisphosphate aldolase 0.0313 0.4124 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0704 0.0879
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0153 0.1918 0.4487
Loa Loa (eye worm) RecQ helicase 0.0022 0.0113 0.0373
Onchocerca volvulus 0.0039 0.0339 0.2791
Brugia malayi jmjC domain containing protein 0.0027 0.0178 0.0586
Loa Loa (eye worm) hypothetical protein 0.0044 0.0409 0.1348
Echinococcus granulosus GPCR family 2 0.0034 0.0279 0.0221
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0482 0.0426
Brugia malayi jmjC domain containing protein 0.0105 0.1249 0.4121
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0039 0.0341 0.0814
Schistosoma mansoni hypothetical protein 0.0034 0.0279 0.0247
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0339 0.0808
Schistosoma mansoni survival motor neuron protein 0.0048 0.0465 0.0433
Loa Loa (eye worm) hypothetical protein 0.0077 0.0873 0.2881
Loa Loa (eye worm) hypothetical protein 0.007 0.0777 0.2563
Schistosoma mansoni rab6-interacting 0.0021 0.0098 0.0065
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0077 0.0873 0.177
Schistosoma mansoni jumonji domain containing protein 0.0027 0.0178 0.0145
Trypanosoma cruzi WD domain, G-beta repeat/PFU (PLAA family ubiquitin binding), putative 0.0039 0.0339 0.0782
Echinococcus granulosus survival motor neuron protein 1 0.0234 0.3031 0.299
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0482 0.0426
Brugia malayi Bromodomain containing protein 0.0034 0.0272 0.0899
Brugia malayi Glycosyl hydrolases family 31 protein 0.0175 0.2213 0.7302
Loa Loa (eye worm) hypothetical protein 0.0014 0.0006 0.0019
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0051 0.0506 0.0402
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.0341 0.0814
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0339 0.0781
Echinococcus multilocularis neuropeptide s receptor 0.0495 0.6637 0.6618
Loa Loa (eye worm) hypothetical protein 0.0108 0.1298 0.4282
Plasmodium falciparum polyubiquitin binding protein, putative 0.0039 0.0339 0.0596
Mycobacterium ulcerans hypothetical protein 0.017 0.2157 0.4376
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III) 0.034 0.4493 1
Loa Loa (eye worm) WD domain-containing protein 0.0026 0.0165 0.0545
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0026 0.0164 0.0132
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.0341 0.0814
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0339 0.0808
Schistosoma mansoni jumonji/arid domain-containing protein 0.0105 0.1249 0.122
Entamoeba histolytica fatty acid elongase, putative 0.0044 0.0415 0.0995
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.034 0.4493 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0045 0.0434 0.1005
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0313 0.4124 1
Onchocerca volvulus 0.0039 0.0339 0.2791
Brugia malayi PHD-finger family protein 0.0031 0.0237 0.0783
Entamoeba histolytica fatty acid elongase, putative 0.0044 0.0415 0.0995
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0482 0.0451
Toxoplasma gondii hypothetical protein 0.0027 0.0174 0.1889
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.0873 0.1287
Brugia malayi RNA recognition motif domain containing protein 0.0068 0.0743 0.245
Loa Loa (eye worm) hypothetical protein 0.0076 0.0851 0.2809
Echinococcus granulosus bloom syndrome protein 0.0022 0.0113 0.0055
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0178 0.0586
Brugia malayi hypothetical protein 0.0021 0.0098 0.0324
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0704 0.0879
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0696 0.2296
Toxoplasma gondii aldehyde dehydrogenase 0.0065 0.0704 0.8034
Schistosoma mansoni phosphatidylserine receptor 0.0027 0.0178 0.0145
Schistosoma mansoni hypothetical protein 0.0091 0.1055 0.1026
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0153 0.1916 0.3797
Schistosoma mansoni cpg binding protein 0.0031 0.0231 0.0199
Onchocerca volvulus 0.0101 0.1199 1
Schistosoma mansoni loxhd1 0.0021 0.0098 0.0065
Echinococcus multilocularis lysine specific demethylase 5A 0.0101 0.1197 0.1145
Schistosoma mansoni rab6-interacting 0.0021 0.0098 0.0065
Echinococcus granulosus JmjC domain containing protein 4 0.0027 0.0178 0.0119
Echinococcus multilocularis survival motor neuron protein 1 0.0234 0.3031 0.299
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0065 0.0704 0.1638
Echinococcus granulosus lysosomal alpha glucosidase 0.0175 0.2213 0.2167
Echinococcus granulosus cpg binding protein 0.0035 0.0283 0.0226
Trypanosoma cruzi WD domain, G-beta repeat/PFU (PLAA family ubiquitin binding), putative 0.0039 0.0339 0.0782
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0743 0.0712
Trypanosoma cruzi ISWI complex protein 0.0016 0.0033 0.0064
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.0341 0.0814
Schistosoma mansoni alpha-glucosidase 0.015 0.1878 0.1852
Loa Loa (eye worm) beta-lactamase 0.0039 0.0339 0.1117
Toxoplasma gondii histone lysine methyltransferase SET1 0.0061 0.0646 0.7358
Echinococcus multilocularis beta LACTamase domain containing family member 0.0039 0.0339 0.0282
Echinococcus granulosus neuropeptide receptor A26 0.0495 0.6637 0.6618
Schistosoma mansoni hypothetical protein 0.0022 0.0112 0.0079
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0077 0.0873 0.0819
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0027 0.0178 0.0403
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.0341 0.0814
Entamoeba histolytica fatty acid elongase, putative 0.0044 0.0415 0.0995
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0339 0.0808
Echinococcus multilocularis neutral alpha glucosidase AB 0.0039 0.0341 0.0284
Loa Loa (eye worm) hypothetical protein 0.0234 0.3031 1
Loa Loa (eye worm) RNA binding protein 0.0068 0.0743 0.245
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Onchocerca volvulus Alhambra homolog 0.0031 0.0237 0.1943
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Trichomonas vaginalis phospholipase A-2-activating protein, putative 0.0026 0.0165 0.0388
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0237 0.018
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0339 0.0781
Leishmania major hypothetical protein, conserved 0.0016 0.0033 0.0064
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0153 0.1916 0.3797
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0027 0.0178 0.0403
Brugia malayi Calcitonin receptor-like protein seb-1 0.0108 0.1298 0.4282
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0055 0.0571 0.1327
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0027 0.0178 0.1927
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0039 0.0341 0.0814
Brugia malayi RNA binding protein 0.0068 0.0743 0.245
Loa Loa (eye worm) latrophilin receptor protein 2 0.0034 0.0279 0.0919
Schistosoma mansoni hypothetical protein 0.0021 0.0098 0.0065
Loa Loa (eye worm) hypothetical protein 0.0027 0.0178 0.0586
Brugia malayi beta-lactamase 0.0039 0.0339 0.1117
Schistosoma mansoni hypothetical protein 0.0034 0.0279 0.0247
Leishmania major hypothetical protein, conserved 0.0027 0.0178 0.0403
Onchocerca volvulus 0.0039 0.0339 0.2791
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Loa Loa (eye worm) TAR-binding protein 0.0068 0.0743 0.245
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0065 0.0704 0.0649
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0059 0.0622 0.0567
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0246 0.3205 0.6899
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0034 0.0279 0.0221
Schistosoma mansoni zinc finger protein 0.0023 0.012 0.0088
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0066 0.0713 0.0658
Brugia malayi WD domain containing protein 0.0039 0.0339 0.1119
Schistosoma mansoni microtubule-associated protein tau 0.0739 1 1
Echinococcus multilocularis GPCR, family 2 0.0034 0.0279 0.0221
Echinococcus granulosus peregrin 0.0034 0.0272 0.0215
Brugia malayi Bloom's syndrome protein homolog 0.0022 0.0113 0.0373
Brugia malayi Glycosyl hydrolases family 31 protein 0.0014 0.0006 0.0019
Echinococcus multilocularis peptidase Clp (S14 family) 0.0051 0.0506 0.045
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0034 0.0279 0.0221
Brugia malayi jmjC domain containing protein 0.0027 0.0178 0.0586
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0026 0.0164 0.0106
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0068 0.0743 0.245
Schistosoma mansoni lipoxygenase 0.0059 0.0622 0.0591
Echinococcus multilocularis lysine specific demethylase 6a 0.0027 0.0178 0.0119
Mycobacterium leprae Probable lipase LipE 0.0039 0.0339 0.0944
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0077 0.0873 0.4013
Loa Loa (eye worm) hypothetical protein 0.016 0.2013 0.6642
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0341 0.0786
Echinococcus multilocularis microtubule associated protein 2 0.0739 1 1
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0059 0.0026
Trypanosoma brucei ISWI complex protein 0.0016 0.0033 0.0064
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0178 0.0586
Loa Loa (eye worm) jmjC domain-containing protein 0.0105 0.1249 0.4121
Echinococcus granulosus Polycystic kidney disease protein 0.0021 0.0098 0.004
Schistosoma mansoni cpg binding protein 0.0035 0.0283 0.0251
Trypanosoma cruzi ISWI complex protein 0.0016 0.0033 0.0064
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0324 0.4268 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0153 0.1918 0.4487
Echinococcus multilocularis alkaline phosphatase, intestinal, gene 2 0.0174 0.2209 0.2163
Brugia malayi beta-lactamase family protein 0.0039 0.0339 0.1117
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0482 0.0451
Trichomonas vaginalis maltase-glucoamylase, putative 0.0039 0.0341 0.0814
Schistosoma mansoni alpha glucosidase 0.0039 0.0341 0.0309
Echinococcus multilocularis phd:f box containing protein 0.0027 0.0178 0.0119
Schistosoma mansoni lipoxygenase 0.0021 0.0098 0.0065
Echinococcus granulosus neutral alpha glucosidase AB 0.0039 0.0341 0.0284
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0237 0.2623
Schistosoma mansoni hypothetical protein 0.0031 0.0237 0.0205
Schistosoma mansoni hypothetical protein 0.0048 0.0465 0.0433
Echinococcus granulosus phospholipase A 2 activating protein 0.0039 0.0339 0.0282
Brugia malayi Doublecortin family protein 0.0021 0.0098 0.0324
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Onchocerca volvulus 0.0021 0.0098 0.0774
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0027 0.0174 0.0358
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0027 0.0178 0.1927
Echinococcus multilocularis lysosomal alpha glucosidase 0.0175 0.2213 0.2167
Echinococcus multilocularis bloom syndrome protein 0.0022 0.0113 0.0055
Schistosoma mansoni jumonji domain containing protein 0.0144 0.1796 0.1769
Toxoplasma gondii hypothetical protein 0.0052 0.0526 0.5975
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Plasmodium falciparum beta-ketoacyl-ACP synthase III 0.034 0.4493 1
Brugia malayi jmjC domain containing protein 0.0027 0.0178 0.0586
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0065 0.0707 0.0676
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Echinococcus multilocularis tar DNA binding protein 0.0068 0.0743 0.0688
Schistosoma mansoni alkaline phosphatase 0.0174 0.2209 0.2183
Plasmodium vivax beta-ketoacyl-acyl carrier protein synthase III precursor, putative 0.034 0.4493 1
Brugia malayi CXXC zinc finger family protein 0.0031 0.0231 0.0762
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0237 0.0783
Loa Loa (eye worm) hypothetical protein 0.0034 0.0279 0.0919
Trichomonas vaginalis alpha-glucosidase, putative 0.0039 0.0341 0.0814
Schistosoma mansoni jumonji/arid domain-containing protein 0.0105 0.1249 0.122
Brugia malayi latrophilin 2 splice variant baaae 0.0074 0.0826 0.2725
Schistosoma mansoni blooms syndrome DNA helicase 0.0018 0.0049 0.0016
Loa Loa (eye worm) hypothetical protein 0.0018 0.0051 0.0169
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0341 0.0786
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0153 0.1918 0.4487
Echinococcus granulosus intestinal type alkaline phosphatase 0.0174 0.2209 0.2163
Plasmodium vivax JmjC domain containing protein 0.0027 0.0178 0.0365
Trichomonas vaginalis phospholipase A-2-activating protein, putative 0.0039 0.0339 0.0809
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0049 0.0482 0.1592
Trichomonas vaginalis esterase, putative 0.0039 0.0339 0.0808
Brugia malayi jmjC domain containing protein 0.0027 0.0178 0.0586
Echinococcus multilocularis jumonji domain containing 1A 0.0027 0.0178 0.0119
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0039 0.0339 0.1117
Loa Loa (eye worm) hypothetical protein 0.0026 0.0165 0.0545
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.034 0.4493 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0098 0.0324
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0077 0.0873 0.1287
Brugia malayi F/Y-rich N-terminus family protein 0.0022 0.0105 0.0348
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.0465 0.1532
Loa Loa (eye worm) hypothetical protein 0.0047 0.0461 0.1521
Echinococcus multilocularis JmjC domain containing protein 4 0.0027 0.0178 0.0119
Loa Loa (eye worm) bromodomain containing protein 0.0019 0.0068 0.0224
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0077 0.0873 0.1918
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0743 0.0712
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0034 0.0279 0.0919
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0051 0.0506 0.0402
Schistosoma mansoni bromodomain containing protein 0.007 0.0766 0.0735
Leishmania major hypothetical protein, conserved 0.0039 0.0339 0.0782
Trichomonas vaginalis DNA helicase recq1, putative 0.0022 0.0113 0.0261
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0065 0.0704 0.0879
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0743 0.0712
Brugia malayi beta-lactamase family protein 0.0039 0.0339 0.1117
Brugia malayi jmjC domain containing protein 0.0165 0.2086 0.6882
Echinococcus multilocularis phospholipase A 2 activating protein 0.0039 0.0339 0.0282
Brugia malayi Muscleblind-like protein 0.016 0.2013 0.6642
Mycobacterium ulcerans aldehyde dehydrogenase 0.0065 0.0704 0.0879
Schistosoma mansoni phd/f-box containing protein 0.0027 0.0178 0.0145
Echinococcus granulosus lysine specific demethylase 5A 0.0105 0.1249 0.1198
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0019 0.0068 0.0035
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0077 0.0873 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0034 0.0279 0.0221
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0165 0.2086 0.2039
Trypanosoma brucei hypothetical protein, conserved 0.0039 0.0339 0.0781
Echinococcus granulosus RUN 0.0021 0.0098 0.004
Onchocerca volvulus 0.0048 0.0465 0.3846
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0174 0.0223
Trichomonas vaginalis DNA helicase recq, putative 0.0022 0.0113 0.0261
Echinococcus granulosus tar DNA binding protein 0.0068 0.0743 0.0688
Schistosoma mansoni cpg binding protein 0.0035 0.0283 0.0251
Schistosoma mansoni polycystin 1-related 0.0021 0.0098 0.0065
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0313 0.4124 1
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0339 0.0808
Brugia malayi hypothetical protein 0.0234 0.3031 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0019 0.0068 0.0009
Trichomonas vaginalis sucrase-isomaltase, putative 0.0039 0.0341 0.0814
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0039 0.0341 0.0814
Brugia malayi Bromodomain containing protein 0.0041 0.0373 0.1229
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0237 0.0205
Toxoplasma gondii PHD-finger domain-containing protein 0.0031 0.0237 0.2623
Brugia malayi hypothetical protein 0.0021 0.0098 0.0324
Schistosoma mansoni hypothetical protein 0.0034 0.0279 0.0247
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0049 0.0482 0.1592
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0704 0.0673
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0237 0.018
Echinococcus multilocularis muscleblind protein 1 0.016 0.2013 0.1966
Loa Loa (eye worm) hypothetical protein 0.0021 0.0098 0.0324
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0027 0.0178 0.0403
Trypanosoma brucei glucosidase, putative 0.0039 0.0341 0.0786
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0039 0.0339 0.1117
Echinococcus multilocularis alkaline phosphatase 0.0174 0.2209 0.2163
Entamoeba histolytica fatty acid elongase, putative 0.0044 0.0415 0.0995
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.034 0.4493 1
Echinococcus granulosus neuropeptide s receptor 0.0495 0.6637 0.6618
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0324 0.4268 1
Mycobacterium leprae conserved hypothetical protein 0.0039 0.0339 0.0944
Echinococcus multilocularis peregrin 0.0034 0.0272 0.0215
Schistosoma mansoni protein phosphatase 2C 0.0027 0.0178 0.0145
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0045 0.0434 0.1005
Schistosoma mansoni alpha-glucosidase 0.015 0.1878 0.1852
Echinococcus multilocularis muscleblind protein 0.016 0.2013 0.1966
Loa Loa (eye worm) hypothetical protein 0.0019 0.0068 0.0224
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0743 0.0712
Loa Loa (eye worm) jmjC domain-containing protein 0.0027 0.0178 0.0586
Loa Loa (eye worm) hypothetical protein 0.0027 0.0178 0.0586
Loa Loa (eye worm) hypothetical protein 0.0041 0.0374 0.1233
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0324 0.4268 1
Echinococcus multilocularis intestinal type alkaline phosphatase 0.0174 0.2209 0.2163
Plasmodium falciparum JmjC domain-containing protein, putative 0.0027 0.0178 0.023
Echinococcus multilocularis Polycystic kidney disease protein 0.0021 0.0098 0.004
Plasmodium falciparum LCCL domain-containing protein 0.0021 0.0098 0.005
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0038 0.0338 0.0281
Loa Loa (eye worm) hypothetical protein 0.0074 0.0826 0.2725
Echinococcus granulosus lysine specific demethylase 6a 0.0027 0.0178 0.0119
Onchocerca volvulus 0.0021 0.0098 0.0774
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0077 0.0873 0.1805
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0108 0.1298 0.4282
Schistosoma mansoni phospholipase A-2-activating protein 0.0026 0.0165 0.0133
Toxoplasma gondii ABC1 family protein 0.0039 0.0339 0.3797
Echinococcus granulosus muscleblind protein 0.016 0.2013 0.1966
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0034 0.0279 0.0221
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0059 0.0622 0.0567
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0051 0.0506 0.1904
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0339 0.0808
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0482 0.0426
Brugia malayi TAR-binding protein 0.0068 0.0743 0.245
Entamoeba histolytica hypothetical protein 0.0025 0.0154 0.0361
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0038 0.0338 0.0281
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0019 0.0068 0.0009
Trypanosoma brucei WD domain, G-beta repeat/PFU (PLAA family ubiquitin binding), putative 0.0026 0.0165 0.0374
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0237 0.0499
Echinococcus granulosus zinc finger protein 0.0023 0.012 0.0062
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0339 0.0307
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0175 0.2213 0.7302
Loa Loa (eye worm) hypothetical protein 0.0039 0.0339 0.1117
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0045 0.0434 0.1005
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0059 0.0026
Plasmodium vivax multidomain scavenger receptor, putative 0.0021 0.0098 0.0188
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0339 0.0307
Echinococcus multilocularis lysosomal alpha glucosidase 0.0175 0.2213 0.2167
Schistosoma mansoni aldehyde dehydrogenase 0.0065 0.0704 0.0673
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0027 0.0178 0.0145
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0098 0.004
Schistosoma mansoni tar DNA-binding protein 0.0068 0.0743 0.0712
Echinococcus granulosus beta LACTamase domain containing family member 0.0039 0.0339 0.0282
Echinococcus granulosus alkaline phosphatase intestinal gene 2 0.0174 0.2209 0.2163
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0065 0.0704 0.0649

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) = 47.66 uM Huh7 cytotoxicity for Pf inhibitors Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.316 uM W2 Pf proliferation inhibition Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.383 uM PF proliferation inhibition 3D7 Novartis-GNF Malaria Box. No reference
IFI promiscuity index = 0.05263 IFI promiscuity index Novartis-GNF Malaria Box. 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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