Detailed information for compound 115270

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 798.997 | Formula: C42H70O14
  • H donors: 10 H acceptors: 10 LogP: 1.93 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 3
  • SMILES: OCC1OC(OC2C(O)C(OC(C2O)C)O[C@@H]2CC[C@]3(C([C@@]2(C)CO)CC[C@]2(C3[C@@H](O)CC3[C@@]2(C)C[C@@H]([C@]2(C3=CC(C)(C)CC2)CO)O)C)C)C(C(C1O)O)O
  • InChi: 1S/C42H70O14/c1-20-28(48)33(56-35-31(51)30(50)29(49)24(17-43)54-35)32(52)36(53-20)55-27-9-10-38(4)25(39(27,5)18-44)8-11-40(6)34(38)23(46)14-21-22-15-37(2,3)12-13-42(22,19-45)26(47)16-41(21,40)7/h15,20-21,23-36,43-52H,8-14,16-19H2,1-7H3/t20?,21?,23-,24?,25?,26+,27+,28?,29?,30?,31?,32?,33?,34?,35?,36?,38+,39+,40-,41-,42-/m1/s1
  • InChiKey: WTDAWGUIRRPECW-TYZDAVNOSA-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 diacylglycerol kinase 0.002 0.0042 0.0136
Echinococcus multilocularis peroxidasin 0.0076 0.0694 0.0655
Onchocerca volvulus Matrilysin homolog 0.009 0.0851 0.2769
Echinococcus multilocularis geminin 0.059 0.6671 0.6657
Loa Loa (eye worm) latrophilin receptor protein 2 0.0056 0.0452 0.0771
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0203 0.0162
Loa Loa (eye worm) hypothetical protein 0.052 0.5861 1
Brugia malayi Hemopexin family protein 0.0127 0.1288 0.4143
Schistosoma mansoni protein kinase C 0.0025 0.0092 0.0064
Trichomonas vaginalis transmembrane protein nessy, putative 0.0051 0.0397 0.0931
Loa Loa (eye worm) jmjC domain-containing protein 0.004 0.0276 0.047
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Echinococcus multilocularis histone acetyltransferase MYST2 0.0127 0.1288 0.1251
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0138 0.1408 0.2403
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0021 0.005 0.0159
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0194 0.4277
Entamoeba histolytica hypothetical protein 0.0051 0.0397 0.2924
Echinococcus multilocularis protein kinase c epsilon type 0.0053 0.0427 0.0386
Plasmodium vivax SET domain protein, putative 0.0034 0.0203 0.4111
Brugia malayi DnaJ domain containing protein 0.007 0.0622 0.2
Brugia malayi Peroxidasin 0.0076 0.0694 0.2232
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0176 0.185 0.5949
Mycobacterium ulcerans 6-phosphofructokinase 0.0124 0.1254 1
Schistosoma mansoni rab6-interacting 0.0023 0.0068 0.0034
Brugia malayi hypothetical protein 0.0076 0.0694 0.2232
Echinococcus multilocularis serine threonine protein kinase 0.0166 0.1736 0.1701
Loa Loa (eye worm) hypothetical protein 0.0051 0.0397 0.0677
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0051 0.0397 0.0535
Echinococcus multilocularis Polycystic kidney disease protein 0.0023 0.0068 0.0026
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0066 0.057 0.1833
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0441 0.4937 0.4916
Schistosoma mansoni loxhd1 0.0023 0.0068 0.0034
Entamoeba histolytica protein kinase, putative 0.0029 0.0141 0.081
Schistosoma mansoni hypothetical protein 0.0051 0.0397 0.0462
Schistosoma mansoni lipoxygenase 0.0023 0.0068 0.0034
Entamoeba histolytica hypothetical protein 0.0041 0.0285 0.2001
Onchocerca volvulus 0.0034 0.0203 0.0551
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0124 0.1254 1
Echinococcus multilocularis lamin dm0 0.0031 0.0169 0.0127
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0112 0.1108 0.1387
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0034 0.0197 0.1274
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Brugia malayi Animal haem peroxidase family protein 0.0076 0.0694 0.2232
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0051 0.0397 0.0462
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0061 0.0519 0.0885
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0197 0.3914
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Loa Loa (eye worm) intermediate filament protein 0.0031 0.0169 0.0288
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0155 0.1613 0.1578
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.009 0.0851 0.1053
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0034 0.0197 0.5
Loa Loa (eye worm) matrixin family protein 0.0217 0.2334 0.3982
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0051 0.0397 1
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0051 0.0397 0.0535
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0203 0.021
Brugia malayi Pleckstrin Homology Domain 0.002 0.0042 0.0136
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0041 0.0285 0.0244
Entamoeba histolytica phosphofructokinase, putative 0.0124 0.1254 1
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0051 0.0397 0.2924
Loa Loa (eye worm) hypothetical protein 0.0057 0.0472 0.0805
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0109 0.1078 0.1563
Loa Loa (eye worm) hypothetical protein 0.0031 0.0162 0.0277
Brugia malayi jmjC domain containing protein 0.004 0.0276 0.0887
Loa Loa (eye worm) matrix metalloproteinase 0.009 0.0851 0.1452
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Loa Loa (eye worm) animal heme peroxidase 0.0076 0.0694 0.1184
Onchocerca volvulus 0.0023 0.0068 0.0088
Brugia malayi Matrixin family protein 0.009 0.0851 0.2737
Loa Loa (eye worm) MBOAT family protein 0.0051 0.0397 0.0677
Loa Loa (eye worm) hhat protein 0.0051 0.0397 0.0677
Schistosoma mansoni sex comb on midleg homolog 0.0112 0.1108 0.1387
Brugia malayi 6-phosphofructokinase 0.0124 0.1254 0.4034
Loa Loa (eye worm) hypothetical protein 0.0109 0.1079 0.1841
Schistosoma mansoni hypothetical protein 0.068 0.7722 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0056 0.0452 0.0618
Echinococcus granulosus o acyltransferase membrane bound domain 0.0051 0.0397 0.0535
Loa Loa (eye worm) hypothetical protein 0.0284 0.3109 0.5305
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0194 0.0229
Brugia malayi Matrixin family protein 0.009 0.0851 0.2737
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0155 0.1613 0.237
Loa Loa (eye worm) hypothetical protein 0.0031 0.0169 0.0288
Echinococcus multilocularis dnaJ subfamily C 6 0.007 0.0622 0.0582
Schistosoma mansoni intermediate filament proteins 0.0031 0.0169 0.0165
Brugia malayi mbt repeat family protein 0.0112 0.1108 0.3562
Trypanosoma brucei glycerol uptake protein, putative 0.0051 0.0397 0.23
Echinococcus multilocularis lipoxygenase domain containing protein 0.0023 0.0068 0.0026
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0327 0.3608 0.5379
Entamoeba histolytica hypothetical protein, conserved 0.0051 0.0397 0.2924
Entamoeba histolytica protein kinase, putative 0.0029 0.0141 0.081
Loa Loa (eye worm) AGC/PKN protein kinase 0.0029 0.0141 0.024
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Schistosoma mansoni serine/threonine kinase 0.0029 0.0141 0.0128
Brugia malayi Bromodomain containing protein 0.0033 0.0194 0.0624
Loa Loa (eye worm) raf kinase 0.002 0.0042 0.0072
Brugia malayi Blistered cuticle protein 3 0.0076 0.0694 0.2232
Entamoeba histolytica phosphofructokinase, putative 0.0124 0.1254 1
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0186 0.1973 0.1939
Brugia malayi Ras association domain family 1 isoform A 0.002 0.0042 0.0136
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0155 0.1613 0.2046
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Loa Loa (eye worm) animal heme peroxidase 0.0076 0.0694 0.1184
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0109 0.1079 0.7439
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0176 0.185 0.3156
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0051 0.0397 0.0462
Brugia malayi MBOAT family protein 0.0051 0.0397 0.1276
Brugia malayi Animal haem peroxidase family protein 0.0076 0.0694 0.2232
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0029 0.0141 0.0148
Brugia malayi protein kinase C3,putative 0.0021 0.005 0.0159
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Trichomonas vaginalis phosphofructokinase, putative 0.0124 0.1254 0.3962
Echinococcus multilocularis GPCR, family 2 0.0056 0.0452 0.0412
Echinococcus multilocularis conserved hypothetical protein 0.0284 0.3106 0.3077
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0066 0.057 0.053
Onchocerca volvulus 0.0271 0.2963 1
Schistosoma mansoni serine/threonine protein kinase 0.0029 0.0141 0.0128
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0021 0.005 0.0085
Schistosoma mansoni serine/threonine protein kinase 0.0029 0.0141 0.0128
Brugia malayi Animal haem peroxidase family protein 0.0076 0.0694 0.2232
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0276 0.0304
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0051 0.0397 0.0356
Loa Loa (eye worm) AGC/AKT protein kinase 0.0029 0.0141 0.024
Echinococcus multilocularis lipoxygenase domain containing protein 0.0023 0.0068 0.0026
Schistosoma mansoni hypothetical protein 0.0033 0.0194 0.0197
Brugia malayi mbt repeat family protein 0.0112 0.1108 0.3562
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0327 0.3608 0.3581
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0066 0.057 0.0687
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0029 0.0141 0.024
Echinococcus granulosus GPCR family 2 0.0056 0.0452 0.0618
Entamoeba histolytica hypothetical protein 0.0041 0.0285 0.2001
Brugia malayi Latrophilin receptor protein 2 0.0056 0.0452 0.1454
Schistosoma mansoni hypothetical protein 0.059 0.6671 0.8631
Schistosoma mansoni lipoxygenase 0.0063 0.0541 0.065
Brugia malayi 6-phosphofructokinase 0.0124 0.1254 0.4034
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0203 0.021
Loa Loa (eye worm) hypothetical protein 0.0133 0.1352 0.2306
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0051 0.0397 0.0462
Onchocerca volvulus Peroxidasin homolog 0.0076 0.0694 0.2232
Brugia malayi intermediate filament protein 0.0031 0.0169 0.0543
Schistosoma mansoni survival motor neuron protein 0.0058 0.0479 0.0569
Schistosoma mansoni jumonji/arid domain-containing protein 0.004 0.0276 0.0304
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Entamoeba histolytica protein kinase, putative 0.0029 0.0141 0.081
Schistosoma mansoni hypothetical protein 0.0058 0.0479 0.0569
Loa Loa (eye worm) hypothetical protein 0.0051 0.0397 0.0677
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0029 0.0141 0.0148
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Loa Loa (eye worm) jmjC domain-containing protein 0.0069 0.0608 0.1037
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Loa Loa (eye worm) 6-phosphofructokinase 0.0124 0.1254 0.214
Schistosoma mansoni protein kinase C mu 0.0021 0.005 0.0009
Schistosoma mansoni sterol O-acyltransferase 1 0.052 0.5861 0.7576
Loa Loa (eye worm) hypothetical protein 0.0023 0.0068 0.0116
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0051 0.0397 0.0462
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0029 0.0141 0.0148
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0056 0.0452 0.0412
Onchocerca volvulus Peroxidase homolog 0.0076 0.0694 0.2232
Entamoeba histolytica hypothetical protein 0.0041 0.0285 0.2001
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Mycobacterium ulcerans hydrolase 0.0109 0.1079 0.7439
Schistosoma mansoni serine/threonine protein kinase 0.0021 0.005 0.0009
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0155 0.1613 0.1578
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Schistosoma mansoni serine/threonine protein kinase 0.0029 0.0141 0.0128
Loa Loa (eye worm) 6-phosphofructokinase 0.0124 0.1254 0.214
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0203 0.021
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0441 0.4937 0.7385
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0238 0.258 0.4402
Echinococcus granulosus polycomb protein SCMH1 0.0112 0.1108 0.1607
Echinococcus granulosus protein kinase C gamma type 0.0166 0.1736 0.2555
Schistosoma mansoni serine/threonine protein kinase 0.0029 0.0141 0.0128
Trypanosoma brucei RNA helicase, putative 0.0119 0.1185 0.9379
Schistosoma mansoni myelin transcription factor 1 myt1 0.0127 0.1288 0.1622
Schistosoma mansoni rab6-interacting 0.0023 0.0068 0.0034
Brugia malayi jmjC domain containing protein 0.0109 0.1078 0.3468
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0051 0.0397 0.0356
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0397 0.0931
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Brugia malayi Animal haem peroxidase family protein 0.0076 0.0694 0.2232
Echinococcus multilocularis lamin 0.0031 0.0169 0.0127
Echinococcus multilocularis RNA directed DNA polymerase 0.0133 0.1352 0.1315
Schistosoma mansoni hypothetical protein 0.007 0.0622 0.0755
Brugia malayi Protein kinase c protein 2 0.0158 0.1645 0.5291
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0029 0.0141 0.024
Brugia malayi Animal haem peroxidase family protein 0.0076 0.0694 0.2232
Schistosoma mansoni glucose-6-phosphatase 0.0285 0.3128 0.4017
Echinococcus granulosus o acyltransferase membrane bound domain 0.0051 0.0397 0.0535
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Trichomonas vaginalis protein kinase inhibitor, putative 0.007 0.0622 0.1727
Brugia malayi Protein kinase domain containing protein 0.0029 0.0141 0.0452
Entamoeba histolytica vacuolar protein sorting 26 0.0051 0.0397 0.2924
Schistosoma mansoni serine/threonine protein kinase 0.0053 0.0427 0.0501
Loa Loa (eye worm) RasGEF domain-containing protein 0.002 0.0042 0.0072
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0051 0.0397 0.0356
Echinococcus granulosus lamin 0.0031 0.0169 0.0191
Echinococcus multilocularis RUN 0.0023 0.0068 0.0026
Onchocerca volvulus 0.0058 0.0479 0.1496
Loa Loa (eye worm) hypothetical protein 0.0112 0.1108 0.189
Loa Loa (eye worm) mbt repeat family protein 0.0112 0.1108 0.189
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0051 0.0397 0.0356
Loa Loa (eye worm) hypothetical protein 0.0176 0.185 0.3156
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0203 0.0162
Schistosoma mansoni hypothetical protein 0.0056 0.0452 0.0534
Echinococcus granulosus peregrin 0.0033 0.0194 0.0229
Loa Loa (eye worm) DnaJ domain-containing protein 0.007 0.0622 0.1061
Schistosoma mansoni serine/threonine protein kinase 0.0186 0.1973 0.2514
Loa Loa (eye worm) hypothetical protein 0.009 0.0851 0.1452
Echinococcus granulosus NDR protein kinase 0.0029 0.0141 0.0148
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0063 0.0541 0.0501
Onchocerca volvulus Peroxidasin homolog 0.0076 0.0694 0.2232
Schistosoma mansoni hypothetical protein 0.0023 0.0068 0.0034
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0025 0.0092 0.0074
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0197 0.3914
Schistosoma mansoni transcription factor LCR-F1 0.0041 0.0285 0.0316
Echinococcus granulosus RUN 0.0023 0.0068 0.0039
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0051 0.0397 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0155 0.1613 0.237
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0203 0.0243
Schistosoma mansoni atypical protein kinase C 0.0049 0.0378 0.0437
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Brugia malayi C1-like domain containing protein 0.0021 0.005 0.0159
Echinococcus multilocularis unc 13 (munc13) 0.0025 0.0092 0.0049
Loa Loa (eye worm) variant SH3 domain-containing protein 0.002 0.0042 0.0072
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Entamoeba histolytica protein kinase, putative 0.0029 0.0141 0.081
Brugia malayi hypothetical protein 0.0023 0.0068 0.0219
Echinococcus multilocularis sterol O acyltransferase 1 0.052 0.5861 0.5843
Echinococcus multilocularis conserved hypothetical protein 0.0284 0.3106 0.3077
Schistosoma mansoni lamin 0.0031 0.0169 0.0165
Brugia malayi latrophilin 2 splice variant baaae 0.012 0.1203 0.3868
Schistosoma mansoni hypothetical protein 0.0127 0.1288 0.1622
Echinococcus granulosus dnaJ subfamily C 6 0.007 0.0622 0.0874
Brugia malayi Matrixin family protein 0.0217 0.2334 0.7506
Trichomonas vaginalis porcupine, putative 0.0051 0.0397 0.0931
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0051 0.0397 0.0356
Schistosoma mansoni unc-13 (munc13) 0.0025 0.0092 0.0064
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0034 0.0197 0.5
Echinococcus multilocularis serine:threonine protein kinase N2 0.0029 0.0141 0.0099
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0155 0.1613 0.2046
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Loa Loa (eye worm) AGC/NDR protein kinase 0.0029 0.0141 0.024
Brugia malayi MBOAT family protein 0.0051 0.0397 0.1276
Loa Loa (eye worm) hypothetical protein 0.0127 0.1288 0.2197
Echinococcus granulosus intermediate filament protein 0.0031 0.0169 0.0191
Loa Loa (eye worm) MBOAT family protein 0.0051 0.0397 0.0677
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0051 0.0397 0.0677
Echinococcus granulosus unc 13 munc13 0.0025 0.0092 0.0074
Echinococcus granulosus geminin 0.059 0.6671 1
Echinococcus granulosus survival motor neuron protein 1 0.0284 0.3109 0.4627
Loa Loa (eye worm) hypothetical protein 0.0051 0.0397 0.0677
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0155 0.1613 0.2753
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0127 0.1288 0.4142
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0133 0.1352 0.1315
Brugia malayi Protein kinase domain containing protein 0.0029 0.0141 0.0452
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0051 0.0397 1
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0127 0.1288 0.1879
Brugia malayi RhoGEF domain containing protein 0.002 0.0042 0.0136
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0051 0.0397 0.0535
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0051 0.0397 0.0535
Loa Loa (eye worm) animal heme peroxidase 0.0076 0.0694 0.1184
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0051 0.0397 0.0462
Loa Loa (eye worm) hypothetical protein 0.009 0.0851 0.1452
Echinococcus granulosus lipoxygenase domain containing protein 0.0023 0.0068 0.0039
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0197 0.3914
Brugia malayi PHD-finger family protein 0.0033 0.0194 0.0624
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0051 0.0397 0.0356
Brugia malayi MBOAT family protein 0.0051 0.0397 0.1276
Onchocerca volvulus Matrix metalloproteinase homolog 0.0199 0.2125 0.713
Schistosoma mansoni sex comb on midleg homolog 0.0112 0.1108 0.1387
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Echinococcus granulosus histone acetyltransferase MYST2 0.0127 0.1288 0.1879
Loa Loa (eye worm) hypothetical protein 0.0056 0.0452 0.0771
Brugia malayi Variant SH3 domain containing protein 0.002 0.0042 0.0136
Echinococcus granulosus jumonji domain containing protein 0.0046 0.0346 0.0458
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Treponema pallidum alginate O-acetylation protein (algI) 0.0051 0.0397 0.1891
Schistosoma mansoni hypothetical protein 0.0056 0.0452 0.0534
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0479 0.1541
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0095 0.0909 0.1129
Schistosoma mansoni serine/threonine protein kinase 0.0186 0.1973 0.2514
Onchocerca volvulus Dual oxidase homolog 0.0076 0.0694 0.2232
Brugia malayi diacylglycerol acyltransferase 0.0051 0.0397 0.1276
Brugia malayi Hhat protein 0.0051 0.0397 0.1276
Toxoplasma gondii 6-phosphofructokinase 0.0034 0.0197 0.4357
Echinococcus granulosus protein kinase c iota type 0.0049 0.0378 0.0506
Entamoeba histolytica phosphofructokinase, putative 0.0124 0.1254 1
Leishmania major ATP-dependent phosphofructokinase 0.0124 0.1254 1
Brugia malayi hypothetical protein 0.0284 0.3109 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0029 0.0141 0.0099
Loa Loa (eye worm) hypothetical protein 0.0034 0.0203 0.0347
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0021 0.005 0.0011
Trichomonas vaginalis phosphofructokinase, putative 0.0124 0.1254 0.3962
Schistosoma mansoni hypothetical protein 0.0056 0.0452 0.0534
Echinococcus multilocularis SAM and MBT domain containing protein 0.0112 0.1108 0.107
Brugia malayi diacylglycerol kinase 0.002 0.0042 0.0136
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0066 0.057 0.0796
Schistosoma mansoni hypothetical protein 0.0056 0.0452 0.0534
Onchocerca volvulus 0.0051 0.0397 0.1214
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Schistosoma mansoni hypothetical protein 0.059 0.6671 0.8631
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0194 0.4277
Loa Loa (eye worm) hhat protein 0.0051 0.0397 0.0677
Loa Loa (eye worm) hypothetical protein 0.0029 0.0141 0.024
Echinococcus multilocularis musashi 0.0031 0.0169 0.0127
Onchocerca volvulus 0.0023 0.0068 0.0088
Echinococcus granulosus protein kinase c epsilon type 0.0053 0.0427 0.058
Loa Loa (eye worm) hypothetical protein 0.012 0.1203 0.2052
Onchocerca volvulus Matrilysin homolog 0.0199 0.2125 0.713
Schistosoma mansoni hypothetical protein 0.0119 0.1185 0.1488
Loa Loa (eye worm) MBOAT family protein 0.0051 0.0397 0.0677
Brugia malayi Protein kinase domain containing protein 0.0029 0.0141 0.0452
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0029 0.0141 0.024
Brugia malayi Calcitonin receptor-like protein seb-1 0.0176 0.185 0.5949
Brugia malayi Doublecortin family protein 0.0023 0.0068 0.0219
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0197 0.3914
Brugia malayi hypothetical protein 0.0023 0.0068 0.0219
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0051 0.0397 0.0356
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0063 0.0541 0.0753
Brugia malayi protein kinase C II. 0.0053 0.0427 0.1373
Brugia malayi p70 ribosomal S6 kinase beta 0.0029 0.0141 0.0452
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0127 0.1288 0.1251
Brugia malayi phosphofructokinase 0.0124 0.1254 0.4034
Brugia malayi Protein kinase domain containing protein 0.0021 0.005 0.0159
Brugia malayi MBOAT family protein 0.0051 0.0397 0.1276
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0021 0.005 0.0007
Schistosoma mansoni peroxidasin 0.0076 0.0694 0.0849
Onchocerca volvulus 0.0076 0.0694 0.2232
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Echinococcus multilocularis 6 phosphofructokinase 0.0124 0.1254 0.1217
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0051 0.0397 0.0462
Toxoplasma gondii AGC kinase 0.0029 0.0141 0.2771
Schistosoma mansoni hypothetical protein 0.012 0.1203 0.1511
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0029 0.0141 0.0099
Echinococcus multilocularis jumonji domain containing protein 0.0046 0.0346 0.0305
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0021 0.005 0.0085
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0112 0.1108 0.3647
Brugia malayi Hr1 repeat family protein 0.0029 0.0141 0.0452
Plasmodium falciparum phd finger protein, putative 0.0033 0.0194 0.3828
Loa Loa (eye worm) matrixin family protein 0.0199 0.2125 0.3626
Onchocerca volvulus 0.009 0.0851 0.2769
Onchocerca volvulus 0.0076 0.0694 0.2232
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0194 0.3828
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0056 0.0452 0.0412
Echinococcus multilocularis protein kinase c iota type 0.0049 0.0378 0.0337
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0066 0.057 0.2021
Onchocerca volvulus 0.0112 0.1108 0.3647
Onchocerca volvulus 0.0127 0.1288 0.4266
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0109 0.1079 0.347
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0124 0.1254 1
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0194 0.0197
Trichomonas vaginalis phosphofructokinase, putative 0.0124 0.1254 0.3962
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0056 0.0452 0.1454
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0109 0.1078 0.104
Toxoplasma gondii hypothetical protein 0.0051 0.0397 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0155 0.1613 0.5189
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0025 0.0092 0.0049
Brugia malayi Pre-SET motif family protein 0.0034 0.0203 0.0654
Echinococcus granulosus lysine specific demethylase 5A 0.004 0.0276 0.0352
Trichomonas vaginalis AGC family protein kinase 0.0029 0.0141 0.0026
Trypanosoma brucei glycerol uptake protein, putative 0.0051 0.0397 0.23
Schistosoma mansoni hypothetical protein 0.0041 0.0285 0.0316
Echinococcus granulosus peroxidasin 0.0076 0.0694 0.0983
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0051 0.0397 0.0677
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0029 0.0141 0.0099
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0053 0.0427 0.0728
Entamoeba histolytica hypothetical protein 0.0041 0.0285 0.2001
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0189 0.0221
Toxoplasma gondii phosphofructokinase PFKII 0.0034 0.0197 0.4357
Onchocerca volvulus 0.0031 0.0169 0.0433
Echinococcus granulosus sterol O acyltransferase 1 0.052 0.5861 0.8778
Schistosoma mansoni peroxidasin 0.0076 0.0694 0.0849
Onchocerca volvulus 0.0076 0.0694 0.2232
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0051 0.0397 1
Schistosoma mansoni 6-phosphofructokinase 0.0124 0.1254 0.1578
Loa Loa (eye worm) MBCTL1 0.0127 0.1288 0.2197
Schistosoma mansoni polycystin 1-related 0.0023 0.0068 0.0034
Loa Loa (eye worm) blistered cuticle protein 3 0.0076 0.0694 0.1184
Loa Loa (eye worm) hypothetical protein 0.0469 0.5269 0.8991
Schistosoma mansoni unc-13 (munc13) 0.0025 0.0092 0.0064
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0051 0.0397 0.2924
Trichomonas vaginalis phosphofructokinase, putative 0.0124 0.1254 0.3962
Brugia malayi MBOAT family protein 0.0051 0.0397 0.1276
Echinococcus granulosus lipoxygenase domain containing protein 0.0023 0.0068 0.0039
Brugia malayi Intermediate filament tail domain containing protein 0.0031 0.0169 0.0543
Brugia malayi hypothetical protein 0.0041 0.0285 0.0916
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0034 0.0197 1
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.002 0.0042 0.0072
Echinococcus multilocularis survival motor neuron protein 1 0.0284 0.3109 0.308
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0397 0.0931
Echinococcus granulosus serine:threonine protein kinase N2 0.0029 0.0141 0.0148
Echinococcus granulosus o acyltransferase membrane bound domain 0.0051 0.0397 0.0535
Loa Loa (eye worm) hypothetical protein 0.009 0.0851 0.1452
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0034 0.0197 0.4357
Loa Loa (eye worm) animal heme peroxidase 0.0076 0.0694 0.1184
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0194 0.0152
Echinococcus multilocularis peregrin 0.0033 0.0194 0.0152
Onchocerca volvulus 0.0025 0.0092 0.0169
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0034 0.0197 0.0224
Loa Loa (eye worm) hypothetical protein 0.0025 0.0092 0.0156
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0029 0.0141 0.024
Brugia malayi RhoGAP domain containing protein 0.002 0.0042 0.0136
Onchocerca volvulus Alhambra homolog 0.0033 0.0194 0.0519
Brugia malayi Matrixin family protein 0.009 0.0851 0.2737
Echinococcus granulosus Polycystic kidney disease protein 0.0023 0.0068 0.0039
Onchocerca volvulus Chorion peroxidase homolog 0.0076 0.0694 0.2232
Loa Loa (eye worm) hypothetical protein 0.0033 0.0194 0.0331
Trichomonas vaginalis set domain proteins, putative 0.0271 0.2963 1
Loa Loa (eye worm) RhoGAP domain-containing protein 0.002 0.0042 0.0072
Echinococcus granulosus SAM and MBT domain containing protein 0.0112 0.1108 0.1607
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0051 0.0397 0.0356
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0041 0.0285 0.0366
Schistosoma mansoni lamin 0.0031 0.0169 0.0165
Echinococcus granulosus 6 phosphofructokinase 0.0124 0.1254 0.1828
Echinococcus multilocularis serine:threonine protein kinase N2 0.0029 0.0141 0.0099
Echinococcus multilocularis serine:threonine protein kinase 38 0.0029 0.0141 0.0099
Brugia malayi Pre-SET motif family protein 0.0238 0.258 0.8297
Loa Loa (eye worm) hypothetical protein 0.0076 0.0694 0.1184
Onchocerca volvulus 0.0031 0.0169 0.0433
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0051 0.0397 0.0535
Loa Loa (eye worm) hypothetical protein 0.0023 0.0068 0.0116
Echinococcus multilocularis polycomb protein SCMH1 0.0112 0.1108 0.107
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0124 0.1254 1
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0056 0.0452 0.0618
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0194 0.0331
Echinococcus granulosus lamin dm0 0.0031 0.0169 0.0191
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0031 0.0169 0.0288
Brugia malayi RhoGAP domain containing protein 0.002 0.0042 0.0136
Schistosoma mansoni zinc finger protein 0.0051 0.0397 0.0462
Schistosoma mansoni serine/threonine protein kinase 0.0021 0.005 0.0009
Echinococcus multilocularis lysine specific demethylase 5A 0.004 0.0276 0.0234
Echinococcus granulosus RNA directed DNA polymerase 0.0133 0.1352 0.1975
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0124 0.1254 1
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0124 0.1254 1
Onchocerca volvulus Peroxidase homolog 0.0076 0.0694 0.2232
Echinococcus granulosus Protein kinase C brain isozyme 0.0186 0.1973 0.2913
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0397 0.0931
Brugia malayi Matrixin family protein 0.009 0.0851 0.2737
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0203 0.021
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0197 0.0224
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0155 0.1613 0.2046
Schistosoma mansoni jumonji domain containing protein 0.0087 0.0817 0.1008
Schistosoma mansoni 6-phosphofructokinase 0.0124 0.1254 0.1578
Loa Loa (eye worm) hypothetical protein 0.0153 0.1589 0.2711
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0203 0.454
Loa Loa (eye worm) hypothetical protein 0.002 0.0042 0.0072
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0051 0.0397 0.2924
Loa Loa (eye worm) doublecortin family protein 0.0023 0.0068 0.0116
Loa Loa (eye worm) phosphofructokinase 0.0124 0.1254 0.214

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 15.8 % In vitro inhibitory effect on D-Galactosamine induced cytotoxicity in primary cultured rat hepatocytes at 0.3 microg/mL ChEMBL. No reference
Inhibition (functional) = 39.7 % In vitro inhibitory effect on D-Galactosamine induced cytotoxicity in primary cultured rat hepatocytes at 1 microg/mL ChEMBL. No reference
Inhibition (functional) = 59.4 % In vitro inhibitory effect on D-Galactosamine induced cytotoxicity in primary cultured rat hepatocytes at 3 microg/mL ChEMBL. No reference
Inhibition (functional) = 64.7 % In vitro inhibitory effect on D-Galactosamine induced cytotoxicity in primary cultured rat hepatocytes at 30 microg/mL ChEMBL. No reference
Inhibition (functional) = 69.5 % In vitro inhibitory effect on D-Galactosamine induced cytotoxicity in primary cultured rat hepatocytes at 10 microg/mL ChEMBL. No reference
s-GOT level (functional) = 1209 Karmen units Inhibitory effect on D-GalN/LPS (injected i.p. dose of 350 mg/kg and 10 microg/kg) induced hepatic injury in mice at 10mg/kg, ip ChEMBL. No reference
s-GPT level (functional) = 1265 Karmen units Inhibitory effect on D-GalN/LPS (injected i.p. dose of 350 mg/kg and 10 microg/kg) induced hepatic injury in mice at 10mg/kg, ip 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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