Detailed information for compound 308286

Basic information

Technical information
  • TDR Targets ID: 308286
  • Name: 6-chloro-N-(2,4-dibromophenyl)-3-hydroxy-2-me thyl-1,1-dioxobenzo[e]thiazine-4-carboxamide
  • MW: 522.596 | Formula: C16H11Br2ClN2O4S
  • H donors: 2 H acceptors: 4 LogP: 4.17 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 2
  • SMILES: Brc1ccc(c(c1)Br)NC(=O)C1=C(O)N(C)S(=O)(=O)c2c1cc(Cl)cc2
  • InChi: 1S/C16H11Br2ClN2O4S/c1-21-16(23)14(10-7-9(19)3-5-13(10)26(21,24)25)15(22)20-12-4-2-8(17)6-11(12)18/h2-7,23H,1H3,(H,20,22)
  • InChiKey: YGLJCPOBGVXDAD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-chloro-N-(2,4-dibromophenyl)-3-hydroxy-2-methyl-1,1-dioxo-benzo[e]thiazine-4-carboxamide
  • 6-chloro-N-(2,4-dibromophenyl)-3-hydroxy-2-methyl-1,1-dioxo-4-benzo[e]thiazinecarboxamide
  • 6-chloro-N-(2,4-dibromophenyl)-3-hydroxy-2-methyl-1,1-dioxo-benzo[e][1,2]thiazine-4-carboxamide
  • 6-chloro-N-(2,4-dibromophenyl)-3-hydroxy-1,1-diketo-2-methyl-benzo[e]thiazine-4-carboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens prostaglandin-endoperoxide synthase 1 (prostaglandin G/H synthase and cyclooxygenase) Starlite/ChEMBL References
Homo sapiens prostaglandin-endoperoxide synthase 2 (prostaglandin G/H synthase and cyclooxygenase) Starlite/ChEMBL References

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 unc-13 (munc13) 0.0301 0.1573 0.1573
Brugia malayi Protein kinase domain containing protein 0.0303 0.1583 0.2167
Brugia malayi C1-like domain containing protein 0.0788 0.4673 0.652
Loa Loa (eye worm) hypothetical protein 0.0292 0.1516 0.171
Schistosoma mansoni intermediate filament proteins 0.0061 0.0044 0.0044
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Onchocerca volvulus 0.0063 0.0057 0.0083
Loa Loa (eye worm) hypothetical protein 0.006 0.0037 0.0042
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Echinococcus multilocularis protein kinase c iota type 0.092 0.5512 0.5507
Entamoeba histolytica hypothetical protein 0.0163 0.0691 0.1802
Echinococcus multilocularis tyrosine protein kinase Abl 0.012 0.0419 0.0407
Brugia malayi MH2 domain containing protein 0.0139 0.0537 0.0694
Echinococcus granulosus tyrosine protein kinase ABL1 0.009 0.0226 0.0214
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0067 0.0083 0.0093
Brugia malayi hypothetical protein 0.0067 0.0083 0.0054
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0303 0.1583 0.1785
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0168 0.0726 0.0726
Brugia malayi protein-tyrosine kinase 0.009 0.0226 0.0256
Echinococcus multilocularis myotubularin protein 13 0.0292 0.1516 0.1505
Echinococcus granulosus Diacylglycerol kinase theta 0.0275 0.1407 0.1397
Echinococcus granulosus tyrosine kinase 0.009 0.0226 0.0214
Echinococcus multilocularis growth factor receptor bound protein 2 0.0098 0.0276 0.0264
Echinococcus granulosus tyrosine protein kinase Btk29A 0.012 0.0419 0.0407
Brugia malayi tRNA modification GTPase TrmE family protein 0.0067 0.0083 0.0054
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0303 0.1583 0.1572
Echinococcus granulosus tyrosine protein kinase csk 0.0154 0.0632 0.062
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0098 0.0276 0.0276
Echinococcus multilocularis tyrosine protein kinase shark 0.1624 1 1
Echinococcus multilocularis peroxidasin 0.0063 0.0057 0.0045
Echinococcus granulosus tyrosine protein kinase Src42A 0.0067 0.0083 0.007
Schistosoma mansoni atypical protein kinase C 0.0945 0.5672 0.5672
Echinococcus multilocularis 0.0067 0.0083 0.007
Brugia malayi Variant SH3 domain containing protein 0.0098 0.0276 0.0327
Onchocerca volvulus 0.0067 0.0083 0.0119
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.012 0.0419 0.0407
Schistosoma mansoni tyrosine kinase 0.009 0.0226 0.0226
Echinococcus multilocularis insulin receptor 0.0216 0.1031 0.102
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0098 0.0276 0.0312
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0168 0.0726 0.0714
Loa Loa (eye worm) hypothetical protein 0.0797 0.4728 0.5333
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.0067 0.0083 0.0083
Loa Loa (eye worm) AGC/NDR protein kinase 0.0303 0.1583 0.1785
Loa Loa (eye worm) hypothetical protein 0.0765 0.4529 0.5108
Schistosoma mansoni tyrosine kinase 0.0216 0.1031 0.1031
Loa Loa (eye worm) AGC/PKN protein kinase 0.0303 0.1583 0.1785
Schistosoma mansoni growth factor receptor-bound protein 0.0098 0.0276 0.0276
Schistosoma mansoni lamin 0.0061 0.0044 0.0044
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0061 0.0044 0.005
Loa Loa (eye worm) hypothetical protein 0.0061 0.0044 0.005
Echinococcus granulosus c src tyrosine kinase 0.0251 0.1255 0.1244
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0076 0.0136 0.0159
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0284 0.1461 0.145
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.009 0.0226 0.0214
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Echinococcus granulosus N chimaerin 0.0343 0.1837 0.1827
Echinococcus granulosus suppressor of cytokine signaling 6 0.0067 0.0083 0.007
Schistosoma mansoni tyrosine kinase 0.0328 0.1745 0.1745
Schistosoma mansoni tyrosine kinase 0.0637 0.3709 0.3709
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0301 0.1573 0.1563
Onchocerca volvulus 0.078 0.462 0.666
Schistosoma mansoni serine/threonine kinase 0.0303 0.1583 0.1583
Schistosoma mansoni tyrosine kinase 0.012 0.0419 0.0419
Brugia malayi Peroxidasin 0.0063 0.0057 0.0019
Echinococcus multilocularis tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0067 0.0083 0.007
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Brugia malayi Protein kinase domain containing protein 0.009 0.0226 0.0256
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0083
Echinococcus granulosus tyrosine protein kinase Blk 0.009 0.0226 0.0214
Echinococcus granulosus raf serine:threonine protein kinase 0.0298 0.155 0.154
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Echinococcus multilocularis N chimaerin 0.0343 0.1837 0.1827
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Echinococcus granulosus suppressor of cytokine signaling 7 0.0067 0.0083 0.007
Loa Loa (eye worm) hypothetical protein 0.0084 0.0191 0.0215
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0788 0.4673 0.5271
Brugia malayi Pleckstrin Homology Domain 0.0292 0.1516 0.2073
Echinococcus multilocularis unc 13 (munc13) 0.0301 0.1573 0.1563
Echinococcus granulosus histone acetyltransferase KAT2B 0.0164 0.0696 0.0684
Echinococcus granulosus tyrosine kinase 0.009 0.0226 0.0214
Brugia malayi Protein kinase domain containing protein 0.0216 0.1031 0.139
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Onchocerca volvulus Peroxidase homolog 0.0063 0.0057 0.0083
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0216 0.1031 0.102
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis lamin dm0 0.0061 0.0044 0.0032
Toxoplasma gondii AGC kinase 0.0303 0.1583 1
Schistosoma mansoni tyrosine kinase 0.0216 0.1031 0.1031
Brugia malayi Variant SH3 domain containing protein 0.0343 0.1837 0.2525
Schistosoma mansoni tyrosine kinase 0.0251 0.1255 0.1255
Schistosoma mansoni tensin 0.0067 0.0083 0.0083
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0067 0.0083 0.007
Echinococcus granulosus myotubularin protein 13 0.0292 0.1516 0.1505
Brugia malayi SH2 domain containing protein 0.0221 0.1061 0.1433
Schistosoma mansoni tyrosine kinase 0.1557 0.957 0.957
Echinococcus granulosus protein kinase C gamma type 0.0819 0.487 0.4863
Echinococcus multilocularis tyrosine protein kinase Src64B 0.012 0.0419 0.0407
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0057 0.0019
Onchocerca volvulus 0.0063 0.0057 0.0083
Echinococcus multilocularis Diacylglycerol kinase theta 0.0275 0.1407 0.1397
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0163 0.0691 0.0679
Schistosoma mansoni protein kinase C mu 0.0788 0.4673 0.4673
Loa Loa (eye worm) hypothetical protein 0.1143 0.6936 0.7824
Onchocerca volvulus 0.0067 0.0083 0.0119
Loa Loa (eye worm) hypothetical protein 0.1143 0.6936 0.7824
Schistosoma mansoni hypothetical protein 0.0163 0.0691 0.0691
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Echinococcus granulosus peroxidasin 0.0063 0.0057 0.0045
Brugia malayi protein kinase C II. 0.1176 0.7144 1
Schistosoma mansoni tyrosine kinase 0.012 0.0419 0.0419
Trypanosoma brucei rac serine-threonine kinase, putative 0.032 0.1691 0.5
Entamoeba histolytica hypothetical protein 0.0163 0.0691 0.1802
Brugia malayi diacylglycerol kinase 0.0275 0.1407 0.192
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.049 0.2774 0.2766
Echinococcus multilocularis tyrosine protein kinase csk 0.0154 0.0632 0.062
Echinococcus multilocularis serine:threonine protein kinase 38 0.0303 0.1583 0.1572
Schistosoma mansoni serine/threonine protein kinase 0.0303 0.1583 0.1583
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0303 0.1583 0.1572
Echinococcus multilocularis tensin 0.0067 0.0083 0.007
Loa Loa (eye worm) blistered cuticle protein 3 0.0063 0.0057 0.0065
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.009 0.0226 0.0214
Brugia malayi Blistered cuticle protein 3 0.0063 0.0057 0.0019
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Onchocerca volvulus 0.0061 0.0044 0.0063
Brugia malayi RhoGAP domain containing protein 0.0275 0.1407 0.192
Brugia malayi Protein kinase domain containing protein 0.009 0.0226 0.0256
Echinococcus granulosus insulin receptor 0.0216 0.1031 0.102
Brugia malayi RhoGEF domain containing protein 0.0275 0.1407 0.192
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Entamoeba histolytica protein kinase, putative 0.032 0.1691 0.4767
Onchocerca volvulus 0.009 0.0226 0.0325
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Echinococcus granulosus SH2 domain containing adapter protein F 0.0067 0.0083 0.007
Echinococcus granulosus NCK adaptor protein 0.0098 0.0276 0.0264
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0343 0.1837 0.1837
Onchocerca volvulus 0.0221 0.1061 0.153
Echinococcus granulosus Rac GTPase activating protein 1 0.0275 0.1407 0.1397
Echinococcus multilocularis epidermal growth factor receptor 0.0637 0.3709 0.3701
Brugia malayi Sex muscle abnormal protein 5 0.0098 0.0276 0.0327
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0067 0.0083 0.007
Schistosoma mansoni serine/threonine protein kinase 0.0303 0.1583 0.1583
Entamoeba histolytica SH2-protein kinase domain containing protein 0.009 0.0226 0.0424
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.065 0.3796 0.4282
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.012 0.0419 0.0407
Schistosoma mansoni rac gtpase activating protein 0.0275 0.1407 0.1407
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0057 0.0019
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Brugia malayi Hr1 repeat family protein 0.0303 0.1583 0.2167
Schistosoma mansoni thyroid hormone receptor 0.0158 0.066 0.066
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Schistosoma mansoni adapter molecule crk 0.0098 0.0276 0.0276
Loa Loa (eye worm) TK protein kinase 0.009 0.0226 0.0254
Brugia malayi Protein kinase domain containing protein 0.032 0.1691 0.2319
Echinococcus multilocularis serine:threonine protein kinase N2 0.0303 0.1583 0.1572
Echinococcus multilocularis tyrosine protein kinase Srms 0.009 0.0226 0.0214
Echinococcus granulosus serine:threonine protein kinase N2 0.058 0.3348 0.334
Loa Loa (eye worm) SH2 domain-containing protein 0.0067 0.0083 0.0093
Brugia malayi RhoGAP domain containing protein 0.0343 0.1837 0.2525
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0057 0.0065
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus granulosus tyrosine protein kinase Lyn 0.0129 0.0473 0.0461
Loa Loa (eye worm) hypothetical protein 0.1446 0.8866 1
Loa Loa (eye worm) SRC-1 0.012 0.0419 0.0473
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0303 0.1583 0.1572
Onchocerca volvulus Suppressor of cytokine signaling 7 homolog 0.0067 0.0083 0.0119
Brugia malayi STAT protein, DNA binding domain containing protein 0.0067 0.0083 0.0054
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Schistosoma mansoni suppressor of cytokine signaling 0.0067 0.0083 0.0083
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0301 0.1573 0.1563
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0788 0.4673 0.652
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0057 0.0019
Onchocerca volvulus 0.009 0.0226 0.0325
Loa Loa (eye worm) hypothetical protein 0.049 0.2774 0.3129
Echinococcus multilocularis tensin 0.0067 0.0083 0.007
Echinococcus granulosus intermediate filament protein 0.0061 0.0044 0.0032
Loa Loa (eye worm) hypothetical protein 0.0098 0.0276 0.0312
Echinococcus granulosus expressed conserved protein 0.0067 0.0083 0.007
Brugia malayi diacylglycerol kinase 0.0275 0.1407 0.192
Onchocerca volvulus 0.0797 0.4728 0.6817
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Echinococcus granulosus SH2 motif 0.0067 0.0083 0.007
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.012 0.0419 0.0419
Echinococcus multilocularis RNA directed DNA polymerase 0.049 0.2774 0.2766
Loa Loa (eye worm) STAT protein 0.0067 0.0083 0.0093
Echinococcus multilocularis tyrosine protein kinase ABL1 0.009 0.0226 0.0214
Schistosoma mansoni tensin-related 0.0067 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0301 0.1573 0.1774
Loa Loa (eye worm) hypothetical protein 0.0504 0.2866 0.3232
Loa Loa (eye worm) TK/CSK protein kinase 0.0154 0.0632 0.0712
Entamoeba histolytica protein kinase, putative 0.032 0.1691 0.4767
Echinococcus multilocularis SH2 domain containing adapter protein F 0.0067 0.0083 0.007
Schistosoma mansoni nck2/grb4 0.0098 0.0276 0.0276
Onchocerca volvulus Peroxidase homolog 0.0063 0.0057 0.0083
Schistosoma mansoni diacylglycerol kinase theta 0.0275 0.1407 0.1407
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0351 0.1888 0.1878
Schistosoma mansoni tensin 0.0067 0.0083 0.0083
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0146 0.0585 0.0573
Brugia malayi acetyltransferase, GNAT family protein 0.0168 0.0726 0.096
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Schistosoma mansoni serine/threonine protein kinase 0.1176 0.7144 0.7144
Echinococcus multilocularis tyrosine kinase 0.009 0.0226 0.0214
Schistosoma mansoni vav2 0.036 0.1945 0.1945
Echinococcus granulosus protein kinase c iota type 0.092 0.5512 0.5507
Echinococcus granulosus protein kinase c epsilon type 0.1176 0.7144 0.7141
Loa Loa (eye worm) intermediate filament protein 0.0061 0.0044 0.005
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Echinococcus granulosus tyrosine protein kinase csk 0.0154 0.0632 0.062
Echinococcus granulosus RNA directed DNA polymerase 0.049 0.2774 0.2766
Schistosoma mansoni hypothetical protein 0.0275 0.1407 0.1407
Echinococcus multilocularis protein kinase c eta type 0.0275 0.1407 0.1397
Brugia malayi Protein kinase domain containing protein 0.009 0.0226 0.0256
Entamoeba histolytica diacylglycerol kinase, putative 0.0275 0.1407 0.3926
Echinococcus granulosus tensin 0.0067 0.0083 0.007
Echinococcus granulosus signal transduction protein lnk realted 0.0067 0.0083 0.007
Echinococcus multilocularis tyrosine protein kinase Src42A 0.012 0.0419 0.0407
Schistosoma mansoni serine/threonine protein kinase 0.1094 0.6624 0.6624
Loa Loa (eye worm) SH2 domain-containing protein 0.0199 0.0918 0.1036
Entamoeba histolytica protein kinase, putative 0.0303 0.1583 0.4446
Schistosoma mansoni serine/threonine protein kinase 0.0284 0.1461 0.1461
Echinococcus granulosus phosphatidylinositol 3 kinase regulatory subunit 0.0067 0.0083 0.007
Schistosoma mansoni hypothetical protein 0.0146 0.0585 0.0585
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0275 0.1407 0.1587
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0057 0.0065
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0303 0.1583 0.1572
Echinococcus granulosus tyrosine protein kinase Fps85D 0.009 0.0226 0.0214
Onchocerca volvulus 0.0061 0.0044 0.0063
Echinococcus multilocularis tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Echinococcus multilocularis signal transduction protein lnk realted 0.0067 0.0083 0.007
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Loa Loa (eye worm) TK/INSR protein kinase 0.0216 0.1031 0.1163
Loa Loa (eye worm) TK/EGFR protein kinase 0.0637 0.3709 0.4183
Onchocerca volvulus 0.0067 0.0083 0.0119
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Loa Loa (eye worm) hypothetical protein 0.0504 0.2866 0.3232
Echinococcus multilocularis tyrosine protein kinase Fgr 0.012 0.0419 0.0407
Onchocerca volvulus 0.0301 0.1573 0.2268
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis SH2 motif 0.0067 0.0083 0.007
Schistosoma mansoni serine/threonine protein kinase 0.0303 0.1583 0.1583
Echinococcus multilocularis SH2 motif 0.0067 0.0083 0.007
Echinococcus granulosus unc 13 munc13 0.0301 0.1573 0.1563
Echinococcus multilocularis SH2 motif 0.0067 0.0083 0.007
Echinococcus granulosus tyrosine protein kinase Src42A 0.012 0.0419 0.0407
Schistosoma mansoni tyrosine-protein kinase zap-70 0.0067 0.0083 0.0083
Schistosoma mansoni tensin 0.0067 0.0083 0.0083
Echinococcus granulosus epidermal growth factor receptor 0.0637 0.3709 0.3701
Brugia malayi Tensin 0.0067 0.0083 0.0054
Echinococcus multilocularis suppressor of cytokine signaling 6 0.0067 0.0083 0.007
Schistosoma mansoni tyrosine kinase 0.0328 0.1745 0.1745
Echinococcus granulosus NDR protein kinase 0.0303 0.1583 0.1572
Trichomonas vaginalis AGC family protein kinase 0.0303 0.1583 0.3308
Echinococcus granulosus tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Brugia malayi hypothetical protein 0.009 0.0226 0.0256
Loa Loa (eye worm) hypothetical protein 0.009 0.0226 0.0254
Onchocerca volvulus Suppressor of cytokine signaling at 36E homolog 0.0067 0.0083 0.0119
Echinococcus granulosus SH2 motif 0.0067 0.0083 0.007
Echinococcus multilocularis suppressor of cytokine signaling 7 0.0067 0.0083 0.007
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Echinococcus granulosus tyrosine protein kinase Src64B 0.012 0.0419 0.0407
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0163 0.0691 0.0679
Echinococcus granulosus serine:threonine protein kinase N2 0.0303 0.1583 0.1572
Echinococcus multilocularis Rac GTPase activating protein 1 0.0275 0.1407 0.1397
Schistosoma mansoni serine/threonine protein kinase 0.0284 0.1461 0.1461
Echinococcus multilocularis lamin 0.0061 0.0044 0.0032
Loa Loa (eye worm) variant SH3 domain-containing protein 0.011 0.0357 0.0402
Brugia malayi Protein kinase domain containing protein 0.0284 0.1461 0.1996
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0146 0.0585 0.0573
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0343 0.1837 0.1827
Echinococcus multilocularis Protein kinase C, brain isozyme 0.1094 0.6624 0.662
Loa Loa (eye worm) hypothetical protein 0.1419 0.8691 0.9802
Entamoeba histolytica PH domain containing protein kinase, putative 0.0597 0.3456 1
Onchocerca volvulus 0.1143 0.6936 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0158 0.066 0.0648
Loa Loa (eye worm) raf kinase 0.0275 0.1407 0.1587
Echinococcus granulosus tyrosine protein kinase csk 0.0154 0.0632 0.062
Entamoeba histolytica protein kinase, putative 0.0076 0.0136 0.0159
Echinococcus granulosus SH2 domain containing protein 7 0.0067 0.0083 0.007
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0067 0.0083 0.007
Schistosoma mansoni tyrosine kinase 0.012 0.0419 0.0419
Echinococcus granulosus lamin 0.0061 0.0044 0.0032
Brugia malayi Protein kinase domain containing protein 0.009 0.0226 0.0256
Echinococcus multilocularis epidermal growth factor receptor 0.0351 0.1888 0.1878
Schistosoma mansoni lamin 0.0061 0.0044 0.0044
Entamoeba histolytica diacylglycerol kinase, putative 0.0275 0.1407 0.3926
Schistosoma mansoni serine/threonine protein kinase 0.0298 0.155 0.155
Onchocerca volvulus Chorion peroxidase homolog 0.0063 0.0057 0.0083
Brugia malayi protein kinase C3,putative 0.0625 0.3636 0.5059
Echinococcus multilocularis tyrosine protein kinase Fyn 0.009 0.0226 0.0214
Echinococcus granulosus Protein kinase C brain isozyme 0.1094 0.6624 0.662
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Echinococcus multilocularis c src tyrosine kinase 0.0251 0.1255 0.1244
Brugia malayi Protein kinase domain containing protein 0.0303 0.1583 0.2167
Schistosoma mansoni tyrosine kinase 0.0351 0.1888 0.1888
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Schistosoma mansoni tensin-related 0.0067 0.0083 0.0083
Loa Loa (eye worm) RasGEF domain-containing protein 0.0275 0.1407 0.1587
Onchocerca volvulus 0.009 0.0226 0.0325
Brugia malayi Variant SH3 domain containing protein 0.011 0.0357 0.044
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0343 0.1837 0.1827
Brugia malayi Protein kinase c protein 2 0.08 0.4748 0.6625
Brugia malayi hypothetical protein 0.0163 0.0691 0.0911
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.012 0.0419 0.0407
Trichomonas vaginalis AGC family protein kinase 0.0303 0.1583 0.3308
Echinococcus multilocularis SH2 domain containing protein 7 0.0067 0.0083 0.007
Echinococcus granulosus SHC transforming protein 3 0.0067 0.0083 0.007
Loa Loa (eye worm) hypothetical protein 0.0275 0.1407 0.1587
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Echinococcus multilocularis phosphatidylinositol 3 kinase regulatory subunit 0.0067 0.0083 0.007
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0303 0.1583 0.1572
Schistosoma mansoni signal transduction protein lnk-related 0.0067 0.0083 0.0083
Echinococcus granulosus growth factor receptor bound protein 2 0.0098 0.0276 0.0264
Onchocerca volvulus 0.0063 0.0057 0.0083
Brugia malayi Tyrosine-protein kinase abl-1 0.012 0.0419 0.0529
Echinococcus multilocularis tumor protein p63 0.0372 0.2024 0.2014
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Brugia malayi Variant SH3 domain containing protein 0.0098 0.0276 0.0327
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0253 0.1267 0.5
Brugia malayi SH2 domain containing protein 0.009 0.0226 0.0256
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Entamoeba histolytica hypothetical protein 0.0163 0.0691 0.1802
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Entamoeba histolytica hypothetical protein 0.0163 0.0691 0.1802
Loa Loa (eye worm) hypothetical protein 0.078 0.462 0.5211
Schistosoma mansoni protein kinase C 0.0301 0.1573 0.1573
Loa Loa (eye worm) transcription factor SMAD2 0.0139 0.0537 0.0605
Loa Loa (eye worm) SH2 domain-containing protein 0.0067 0.0083 0.0093
Brugia malayi p70 ribosomal S6 kinase beta 0.0303 0.1583 0.2167
Echinococcus granulosus protein kinase c eta type 0.0275 0.1407 0.1397
Onchocerca volvulus 0.0067 0.0083 0.0119
Brugia malayi SRC-1 0.012 0.0419 0.0529
Trichomonas vaginalis AGC family protein kinase 0.0303 0.1583 0.3308
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0303 0.1583 0.1785
Schistosoma mansoni growth factor receptor-bound protein 0.0098 0.0276 0.0276
Brugia malayi hypothetical protein 0.0063 0.0057 0.0019
Echinococcus multilocularis tyrosine protein kinase Blk 0.009 0.0226 0.0214
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0057 0.0065
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0303 0.1583 0.1572
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis raf serine:threonine protein kinase 0.0298 0.155 0.154
Onchocerca volvulus 0.009 0.0226 0.0325
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Echinococcus multilocularis musashi 0.0061 0.0044 0.0032
Echinococcus granulosus tumor protein p63 0.0372 0.2024 0.2014
Schistosoma mansoni tyrosine kinase 0.0351 0.1888 0.1888
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0216 0.1031 0.102
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Entamoeba histolytica protein kinase, putative 0.0303 0.1583 0.4446
Trichomonas vaginalis AGC family protein kinase 0.032 0.1691 1
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.012 0.0419 0.0407
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0343 0.1837 0.2072
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0524 0.2994 0.3377
Schistosoma mansoni hypothetical protein 0.0067 0.0083 0.0083
Loa Loa (eye worm) cytokine inducible SH2-containing protein 5 0.0067 0.0083 0.0093
Echinococcus multilocularis NCK adaptor protein 0.0098 0.0276 0.0264
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.012 0.0419 0.0407
Schistosoma mansoni SH2A 0.0067 0.0083 0.0083
Schistosoma mansoni peroxidasin 0.0063 0.0057 0.0057
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.1176 0.7144 0.8058
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0513 0.2919 0.3292
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0303 0.1583 0.1785
Echinococcus multilocularis protein kinase c epsilon type 0.1176 0.7144 0.7141
Schistosoma mansoni suppressor of cytokine signaling 0.0067 0.0083 0.0083
Schistosoma mansoni diacylglycerol kinase theta 0.0275 0.1407 0.1407
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0275 0.1407 0.1587
Onchocerca volvulus 0.0067 0.0083 0.0119
Echinococcus multilocularis tyrosine protein kinase csk 0.0154 0.0632 0.062
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Echinococcus multilocularis 0.0191 0.0871 0.086
Brugia malayi SH2 domain containing protein 0.0067 0.0083 0.0054
Echinococcus granulosus lamin dm0 0.0061 0.0044 0.0032
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0057 0.0019
Onchocerca volvulus 0.009 0.0226 0.0325
Brugia malayi Ras association domain family 1 isoform A 0.0275 0.1407 0.192
Echinococcus granulosus tyrosine protein kinase Srms 0.009 0.0226 0.0214
Schistosoma mansoni transcription factor LCR-F1 0.0163 0.0691 0.0691
Echinococcus multilocularis suppressor of cytokine signaling 7 0.0067 0.0083 0.007
Brugia malayi cytokine inducible SH2-containing protein 5 0.0067 0.0083 0.0054
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Echinococcus granulosus tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Echinococcus multilocularis serine threonine protein kinase 0.0819 0.487 0.4863
Onchocerca volvulus Peroxidasin homolog 0.0063 0.0057 0.0083
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0098 0.0276 0.0312
Onchocerca volvulus Peroxidasin homolog 0.0063 0.0057 0.0083
Loa Loa (eye worm) TK/ABL protein kinase 0.009 0.0226 0.0254
Schistosoma mansoni protein kinase C mu 0.0275 0.1407 0.1407
Echinococcus multilocularis tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Echinococcus multilocularis SHC transforming protein 3 0.0067 0.0083 0.007
Schistosoma mansoni peroxidasin 0.0063 0.0057 0.0057
Loa Loa (eye worm) MH2 domain-containing protein 0.0139 0.0537 0.0605
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0067 0.0083 0.0054
Echinococcus multilocularis serine:threonine protein kinase N2 0.0875 0.5224 0.5218
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Schistosoma mansoni unc-13 (munc13) 0.0301 0.1573 0.1573
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0303 0.1583 0.1785
Loa Loa (eye worm) hypothetical protein 0.1143 0.6936 0.7824
Schistosoma mansoni thyroid hormone receptor 0.0158 0.066 0.066
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0284 0.1461 0.145
Brugia malayi Furin-like cysteine rich region family protein 0.0637 0.3709 0.5162
Schistosoma mansoni tyrosine kinase 0.0328 0.1745 0.1745
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0067 0.0083 0.007
Brugia malayi Protein kinase domain containing protein 0.009 0.0226 0.0256
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0057 0.0019
Loa Loa (eye worm) TK/FER protein kinase 0.009 0.0226 0.0254
Schistosoma mansoni GTPase activating protein 0.0067 0.0083 0.0083
Onchocerca volvulus Dual oxidase homolog 0.0063 0.0057 0.0083
Echinococcus granulosus tensin C1 domain containing phosphatase 0.0067 0.0083 0.007
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0057 0.0065
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Schistosoma mansoni tyrosine kinase 0.1624 1 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.012 0.0419 0.0407
Echinococcus granulosus epidermal growth factor receptor 0.0351 0.1888 0.1878
Echinococcus multilocularis tyrosine protein kinase csk 0.0154 0.0632 0.062
Schistosoma mansoni serine/threonine protein kinase 0.0303 0.1583 0.1583
Loa Loa (eye worm) hypothetical protein 0.0063 0.0057 0.0065
Onchocerca volvulus 0.0504 0.2866 0.4131
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0343 0.1837 0.1837
Echinococcus granulosus hypothetical protein 0.0067 0.0083 0.007
Loa Loa (eye worm) acetyltransferase 0.0168 0.0726 0.0819
Echinococcus multilocularis tyrosine protein kinase csk 0.0154 0.0632 0.062
Entamoeba histolytica hypothetical protein 0.0275 0.1407 0.3926
Echinococcus granulosus tyrosine protein kinase Fyn 0.012 0.0419 0.0407
Schistosoma mansoni shc transforming protein 0.0067 0.0083 0.0083
Schistosoma mansoni serine/threonine protein kinase 0.1094 0.6624 0.6624
Onchocerca volvulus 0.0067 0.0083 0.0119
Loa Loa (eye worm) hypothetical protein 0.0067 0.0083 0.0093
Loa Loa (eye worm) AGC/AKT protein kinase 0.032 0.1691 0.1907

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.007 uM Concentration of drug that causes a 50% decrease in the maximal inhibition of Prostaglandin G/H synthase 2 activity as measured by PGE2 production('+' indicates 90-110% inhibition) ChEMBL. 9083488
IC50 (binding) = 0.007 uM Concentration of drug that causes a 50% decrease in the maximal inhibition of Prostaglandin G/H synthase 2 activity as measured by PGE2 production('+' indicates 90-110% inhibition) ChEMBL. 9083488
IC50 (binding) = 0.14 uM Concentration of drug that causes a 50% decrease in the maximal inhibition of Prostaglandin G/H synthase 1 activity as measured by PGE2 production('+' indicates 90-110% inhibition) ChEMBL. 9083488
IC50 (binding) = 0.14 uM Concentration of drug that causes a 50% decrease in the maximal inhibition of Prostaglandin G/H synthase 1 activity as measured by PGE2 production('+' indicates 90-110% inhibition) ChEMBL. 9083488
Imax (binding) = 90 % Highest percent inhibition against Prostaglandin G/H synthase 2 observed on IC50 curve ; Range 90-110% ChEMBL. 9083488
Imax (binding) = 90 % Highest percent inhibition against Prostaglandin G/H synthase 1 observed on IC50 curve ; Range 90-110% ChEMBL. 9083488
Imax (binding) = 90 % Highest percent inhibition against Prostaglandin G/H synthase 2 observed on IC50 curve ; Range 90-110% ChEMBL. 9083488
Imax (binding) = 90 % Highest percent inhibition against Prostaglandin G/H synthase 1 observed on IC50 curve ; Range 90-110% ChEMBL. 9083488
Inhibition (binding) = 59 % Inhibition of human Prostaglandin G/H synthase 1 at 0.1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 59 % Inhibition of human Prostaglandin G/H synthase 1 at 0.1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 90 % Inhibition of human Prostaglandin G/H synthase 2 at 0.1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 90 % Inhibition of human Prostaglandin G/H synthase 2 at 0.1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 97 % Inhibition of human Prostaglandin G/H synthase 2 at 10 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 97 % Inhibition of human Prostaglandin G/H synthase 2 at 1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 97 % Inhibition of human Prostaglandin G/H synthase 2 at 10 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 97 % Inhibition of human Prostaglandin G/H synthase 2 at 1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 99 % Inhibition of human Prostaglandin G/H synthase 1 at 10 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 99 % Inhibition of human Prostaglandin G/H synthase 1 at 1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 99 % Inhibition of human Prostaglandin G/H synthase 1 at 10 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488
Inhibition (binding) = 99 % Inhibition of human Prostaglandin G/H synthase 1 at 1 ug/mL expressed as mean percent inhibition of control PGE-2 production ChEMBL. 9083488

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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