Detailed information for compound 1442463

Basic information

Technical information
  • TDR Targets ID: 1442463
  • Name: N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl ]-2-methoxybenzamide
  • MW: 413.253 | Formula: C21H14Cl2N2O3
  • H donors: 1 H acceptors: 2 LogP: 5.49 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1C(=O)Nc1ccc2c(c1)nc(o2)c1cccc(c1Cl)Cl
  • InChi: 1S/C21H14Cl2N2O3/c1-27-17-8-3-2-5-13(17)20(26)24-12-9-10-18-16(11-12)25-21(28-18)14-6-4-7-15(22)19(14)23/h2-11H,1H3,(H,24,26)
  • InChiKey: HSWBYPOYFLZJEP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]-2-methoxy-benzamide
  • ZINC01510803
  • Oprea1_051187
  • NCGC00098114-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Bacillus subtilis (strain 168) ATP-dependent Clp protease proteolytic subunit Starlite/ChEMBL No references

Predicted pathogen targets for this compound

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

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni tyrosine kinase 0.0147 0.031 0.031
Loa Loa (eye worm) TK/ABL protein kinase 0.1225 0.4768 0.4768
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Onchocerca volvulus Tyrosine kinase homolog 0.0508 0.1801 1
Leishmania major protein kinase, putative 0.0247 0.0723 0.1135
Schistosoma mansoni serine/threonine protein kinase 0.0247 0.0723 0.0723
Loa Loa (eye worm) hypothetical protein 0.0358 0.118 0.118
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0334 0.1082 0.1082
Schistosoma mansoni serine/threonine protein kinase 0.0098 0.0107 0.0107
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.009 0.0073 0.0073
Brugia malayi cell division control protein 2 homolog 0.0178 0.0435 0.0435
Onchocerca volvulus 0.0104 0.0132 0.0733
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0247 0.0723 0.1135
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0092 0.0081 0.0081
Brugia malayi Immunoglobulin I-set domain containing protein 0.069 0.2556 0.2556
Echinococcus multilocularis neuroglian 0.0214 0.0585 0.0585
Echinococcus granulosus cyclin dependent kinase 1 0.0178 0.0435 0.0435
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Loa Loa (eye worm) hypothetical protein 0.0172 0.0412 0.0412
Onchocerca volvulus 0.0104 0.0132 0.0733
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Schistosoma mansoni tyrosine kinase 0.0334 0.1082 0.1082
Brugia malayi hypothetical protein 0.0493 0.1742 0.1742
Loa Loa (eye worm) hypothetical protein 0.0493 0.1742 0.1742
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0291 0.0905 0.0905
Echinococcus multilocularis tyrosine protein kinase HCK 0.0242 0.0702 0.0702
Echinococcus granulosus cyclin dependent kinase 5 activator 1 0.1031 0.3966 0.3966
Echinococcus granulosus tyrosine protein kinase Src42A 0.0236 0.0675 0.0675
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0821 0.3099 0.3099
Echinococcus granulosus tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Schistosoma mansoni tyrosine kinase 0.0821 0.3099 0.3099
Echinococcus granulosus growth factor receptor bound protein 2 0.0092 0.0081 0.0081
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0147 0.031 0.031
Plasmodium falciparum protein kinase 5 0.0178 0.0435 0.5435
Loa Loa (eye worm) hypothetical protein 0.0104 0.0132 0.0132
Brugia malayi Protein kinase domain containing protein 0.0178 0.0435 0.0435
Echinococcus granulosus tyrosine protein kinase shark 0.0104 0.0132 0.0132
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0094 0.0091 0.5
Echinococcus granulosus c src tyrosine kinase 0.0147 0.031 0.031
Schistosoma mansoni tyrosine kinase 0.1412 0.5542 0.5542
Brugia malayi SRC-1 0.0334 0.1082 0.1082
Echinococcus multilocularis insulin receptor 0.0821 0.3099 0.3099
Schistosoma mansoni peptidase Clp (S14 family) 0.0094 0.0091 0.0091
Onchocerca volvulus 0.0104 0.0132 0.0733
Echinococcus granulosus tyrosine protein kinase Blk 0.0291 0.0905 0.0905
Echinococcus granulosus defective proboscis extension response 0.0179 0.0442 0.0442
Entamoeba histolytica protein kinase, putative 0.0242 0.0702 0.5319
Echinococcus multilocularis fructose 1,6 bisphosphatase 1 0.0792 0.2978 0.2978
Onchocerca volvulus 0.0104 0.0132 0.0733
Loa Loa (eye worm) hypothetical protein 0.0358 0.118 0.118
Echinococcus multilocularis epidermal growth factor receptor 0.2489 1 1
Trypanosoma brucei fructose-1,6-bisphosphatase 0.0792 0.2978 1
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Echinococcus multilocularis growth factor receptor bound protein 2 0.0092 0.0081 0.0081
Loa Loa (eye worm) hypothetical protein 0.0252 0.0742 0.0742
Trypanosoma brucei kinetoplastid kinetochore protein 10 0.0247 0.0723 0.1135
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.009 0.0073 0.0073
Echinococcus multilocularis cyclin dependent kinase 0.0178 0.0435 0.0435
Brugia malayi Sex muscle abnormal protein 5 0.0092 0.0081 0.0081
Echinococcus granulosus dual specificity 0.0363 0.1203 0.1203
Echinococcus granulosus cyclin dependent kinase 0.0178 0.0435 0.0435
Brugia malayi Protein kinase domain containing protein 0.0104 0.0132 0.0132
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0179 0.0442 0.0442
Echinococcus granulosus tyrosine protein kinase HCK 0.0242 0.0702 0.0702
Schistosoma mansoni tyrosine kinase 0.0104 0.0132 0.0132
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0295 0.0919 0.1904
Entamoeba histolytica protein kinase, putative 0.0363 0.1203 1
Schistosoma mansoni tyrosine kinase 0.0591 0.2145 0.2145
Brugia malayi Immunoglobulin I-set domain containing protein 0.0179 0.0442 0.0442
Echinococcus multilocularis tyrosine protein kinase shark 0.0104 0.0132 0.0132
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0092 0.0081 0.0081
Schistosoma mansoni tyrosine kinase 0.0147 0.031 0.031
Plasmodium vivax protein kinase Crk2 0.0178 0.0435 0.5435
Schistosoma mansoni tyrosine kinase 0.1356 0.5313 0.5313
Brugia malayi Protein kinase domain containing protein 0.0286 0.0882 0.0882
Schistosoma mansoni adapter molecule crk 0.0092 0.0081 0.0081
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0147 0.031 0.031
Brugia malayi Immunoglobulin I-set domain containing protein 0.0625 0.2288 0.2288
Echinococcus multilocularis tyrosine protein kinase ABL1 0.1225 0.4768 0.4768
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.0591 0.2145 0.2145
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0792 0.2978 1
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0078 0.0023 0.0023
Loa Loa (eye worm) hypothetical protein 0.0252 0.0742 0.0742
Echinococcus multilocularis Immunoglobulin 0.0179 0.0442 0.0442
Brugia malayi Fibronectin type III domain containing protein 0.0179 0.0442 0.0442
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.3149 0.3149
Echinococcus multilocularis cyclin dependent kinase 5 activator 1 0.1031 0.3966 0.3966
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.0591 0.2145 0.2145
Echinococcus multilocularis dual specificity 0.0363 0.1203 0.1203
Plasmodium falciparum protein serine/threonine kinase-1 0.0247 0.0723 1
Schistosoma mansoni tyrosine kinase 0.1412 0.5542 0.5542
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.0363 0.1203 0.1203
Echinococcus granulosus tyrosine protein kinase ABL1 0.1225 0.4768 0.4768
Schistosoma mansoni tyrosine kinase 0.0334 0.1082 0.1082
Echinococcus multilocularis 0.0242 0.07 0.07
Echinococcus granulosus dual specificity protein kinase clk2 0.0247 0.0723 0.0723
Loa Loa (eye worm) hypothetical protein 0.1031 0.3966 0.3966
Echinococcus multilocularis tyrosine protein kinase Blk 0.0291 0.0905 0.0905
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0363 0.1203 0.3022
Echinococcus multilocularis cyclin dependent kinase 1 0.0178 0.0435 0.0435
Schistosoma mansoni serine/threonine protein kinase 0.0178 0.0435 0.0435
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0178 0.0435 0.0435
Echinococcus multilocularis tyrosine protein kinase Srms 0.0291 0.0905 0.0905
Loa Loa (eye worm) hypothetical protein 0.0493 0.1742 0.1742
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0334 0.1082 0.1082
Brugia malayi Variant SH3 domain containing protein 0.0092 0.0081 0.0081
Brugia malayi protein-tyrosine kinase 0.0291 0.0905 0.0905
Schistosoma mansoni tyrosine kinase 0.0821 0.3099 0.3099
Loa Loa (eye worm) TK protein kinase 0.0242 0.0702 0.0702
Schistosoma mansoni growth factor receptor-bound protein 0.0092 0.0081 0.0081
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0179 0.0442 0.0442
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Entamoeba histolytica protein kinase, putative 0.0363 0.1203 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0334 0.1082 0.1082
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Echinococcus multilocularis tyrosine kinase 0.0104 0.0132 0.0132
Schistosoma mansoni serine/threonine protein kinase 0.0363 0.1203 0.1203
Schistosoma mansoni nck2/grb4 0.0092 0.0081 0.0081
Onchocerca volvulus 0.0418 0.1428 0.793
Entamoeba histolytica cell division protein kinase 2, putative 0.0178 0.0435 0.2825
Loa Loa (eye worm) hypothetical protein 0.0092 0.0081 0.0081
Echinococcus granulosus tyrosine protein kinase Src42A 0.0334 0.1082 0.1082
Loa Loa (eye worm) hypothetical protein 0.0217 0.0599 0.0599
Entamoeba histolytica hypothetical protein 0.0363 0.1203 1
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0821 0.3099 0.3099
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0178 0.0435 0.0435
Schistosoma mansoni tyrosine kinase 0.2489 1 1
Brugia malayi Tyrosine-protein kinase abl-1 0.0692 0.2563 0.2563
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0178 0.0435 0.1191
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Echinococcus granulosus tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.0363 0.1203 0.3022
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0094 0.0091 0.0091
Trypanosoma brucei sedoheptulose-1,7-bisphosphatase 0.0295 0.0919 0.1904
Loa Loa (eye worm) TK/ALK protein kinase 0.0285 0.0881 0.0881
Entamoeba histolytica protein kinase domain containing protein 0.0363 0.1203 1
Echinococcus multilocularis tyrosine protein kinase Abl 0.0576 0.2083 0.2083
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Brugia malayi hypothetical protein 0.0104 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0203 0.0538 0.0538
Plasmodium vivax serine/threonine kinase-1, putative 0.0247 0.0723 1
Echinococcus multilocularis c src tyrosine kinase 0.0147 0.031 0.031
Echinococcus granulosus roundabout 2 0.0252 0.0742 0.0742
Leishmania major 0.0792 0.2978 1
Echinococcus granulosus insulin receptor 0.0821 0.3099 0.3099
Brugia malayi Protein kinase domain containing protein 0.0363 0.1203 0.1203
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0179 0.0442 0.0442
Brugia malayi fructose-1,6-bisphosphatase 0.0792 0.2978 0.2978
Echinococcus granulosus tyrosine protein kinase Srms 0.0104 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Echinococcus granulosus epidermal growth factor receptor 0.1412 0.5542 0.5542
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.0363 0.1203 0.3022
Schistosoma mansoni cell adhesion molecule 0.0217 0.0599 0.0599
Trypanosoma brucei kinetoplastid kinetochore protein 19 0.0247 0.0723 0.1135
Schistosoma mansoni fructose-16-bisphosphatase-related 0.0792 0.2978 0.2978
Brugia malayi Protein kinase domain containing protein 0.0104 0.0132 0.0132
Trichomonas vaginalis CMGC family protein kinase 0.0247 0.0723 1
Echinococcus granulosus hypothetical protein 0.0242 0.07 0.07
Schistosoma mansoni serine/threonine protein kinase 0.0178 0.0435 0.0435
Echinococcus granulosus tyrosine kinase 0.0291 0.0905 0.0905
Loa Loa (eye worm) SRC-1 0.0334 0.1082 0.1082
Loa Loa (eye worm) hypothetical protein 0.0242 0.07 0.07
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0236 0.0675 0.0675
Schistosoma mansoni serine/threonine protein kinase 0.0247 0.0723 0.0723
Schistosoma mansoni nephrin 0.0214 0.0585 0.0585
Echinococcus multilocularis cyclin dependent kinase 5 0.0178 0.0435 0.0435
Brugia malayi Protein kinase domain containing protein 0.0104 0.0132 0.0132
Echinococcus multilocularis cyclin dependent kinase 1 0.0178 0.0435 0.0435
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Echinococcus granulosus tyrosine protein kinase Lyn 0.034 0.1106 0.1106
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0334 0.1082 0.1082
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0334 0.1082 0.1082
Loa Loa (eye worm) TK protein kinase 0.0291 0.0905 0.0905
Trypanosoma cruzi kinetoplastid kinetochore protein 19, putative 0.0247 0.0723 0.1135
Echinococcus granulosus tyrosine protein kinase Src64B 0.0334 0.1082 0.1082
Brugia malayi Protein kinase domain containing protein 0.0821 0.3099 0.3099
Schistosoma mansoni tyrosine kinase 0.1356 0.5313 0.5313
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0104 0.0132 0.0132
Echinococcus granulosus cyclin dependent kinase 5 0.0178 0.0435 0.0435
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0291 0.0905 0.0905
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Loa Loa (eye worm) TK protein kinase 0.0625 0.2288 0.2288
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0094 0.0091 0.0091
Entamoeba histolytica cell division protein kinase 2, putative 0.0178 0.0435 0.2825
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Toxoplasma gondii cell-cycle-associated protein kinase CLK, putative 0.0247 0.0723 0.2191
Echinococcus multilocularis fibroblast growth factor receptor 4 0.0591 0.2145 0.2145
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0217 0.0599 0.0599
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0334 0.1082 0.1082
Brugia malayi hypothetical protein 0.0179 0.0442 0.0442
Leishmania major protein kinase, putative 0.0247 0.0723 0.1135
Echinococcus granulosus twitchin 0.022 0.0608 0.0608
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0178 0.0435 0.0435
Loa Loa (eye worm) TK/EGFR protein kinase 0.2489 1 1
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.1412 0.5542 0.5542
Brugia malayi Tyrosine-protein kinase abl-1 0.0576 0.2083 0.2083
Toxoplasma gondii sedoheptulose-1,7-bisphosphatase 0.0295 0.0919 0.2869
Loa Loa (eye worm) fructose-1,6-bisphosphatase 0.0792 0.2978 0.2978
Echinococcus multilocularis 0.0839 0.3173 0.3173
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0247 0.0723 0.1135
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0094 0.0091 0.5
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0092 0.0081 0.0081
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0792 0.2978 1
Echinococcus granulosus NCK adaptor protein 0.0092 0.0081 0.0081
Loa Loa (eye worm) TK/ROR protein kinase 0.009 0.0073 0.0073
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0334 0.1082 0.1082
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0295 0.0919 0.1904
Trypanosoma cruzi kinetoplastid kinetochore protein 10, putative 0.0247 0.0723 0.1135
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.3149 0.3149
Echinococcus granulosus epidermal growth factor receptor 0.2489 1 1
Schistosoma mansoni tyrosine kinase 0.0128 0.0229 0.0229
Schistosoma mansoni tyrosine kinase 0.1356 0.5313 0.5313
Brugia malayi Protein kinase domain containing protein 0.0247 0.0723 0.0723
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Loa Loa (eye worm) CMGC/CLK protein kinase 0.0247 0.0723 0.0723
Schistosoma mansoni vesicular amine transporter 0.0179 0.0442 0.0442
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.0363 0.1203 0.3022
Brugia malayi Protein kinase domain containing protein 0.0104 0.0132 0.0132
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Schistosoma mansoni tyrosine kinase 0.0104 0.0132 0.0132
Echinococcus granulosus Immunoglobulin 0.0179 0.0442 0.0442
Brugia malayi Probable ClpP-like protease 0.0094 0.0091 0.0091
Loa Loa (eye worm) TK/FER protein kinase 0.0104 0.0132 0.0132
Echinococcus granulosus microtubule associated protein 2 0.0833 0.3149 0.3149
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0334 0.1082 0.1082
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0147 0.031 0.031
Echinococcus granulosus tyrosine protein kinase Fyn 0.0334 0.1082 0.1082
Schistosoma mansoni cyclin-dependent kinase 5 activator 0.1031 0.3966 0.3966
Echinococcus multilocularis epidermal growth factor receptor 0.1412 0.5542 0.5542
Onchocerca volvulus 0.0104 0.0132 0.0733
Loa Loa (eye worm) hypothetical protein 0.0094 0.0091 0.0091
Loa Loa (eye worm) hypothetical protein 0.0179 0.0442 0.0442
Giardia lamblia Kinase, CMGC CLK 0.0247 0.0723 1
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0178 0.0435 0.0435
Onchocerca volvulus 0.0104 0.0132 0.0733
Echinococcus granulosus fructose 16 bisphosphatase 1 0.0792 0.2978 0.2978
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0104 0.0132 0.0132
Echinococcus multilocularis roundabout 2 0.0252 0.0742 0.0742
Echinococcus multilocularis Immunoglobulin 0.0179 0.0442 0.0442
Echinococcus multilocularis dual specificity protein kinase clk2 0.0247 0.0723 0.0723
Loa Loa (eye worm) TK/KIN16 protein kinase 0.069 0.2556 0.2556
Echinococcus granulosus tyrosine kinase 0.0104 0.0132 0.0132
Brugia malayi SH2 domain containing protein 0.0104 0.0132 0.0132
Echinococcus granulosus neuroglian 0.0214 0.0585 0.0585
Brugia malayi SH2 domain containing protein 0.0104 0.0132 0.0132
Echinococcus granulosus macrophage colony stimulating factor 1 receptor 0.2143 0.8569 0.8569
Brugia malayi Variant SH3 domain containing protein 0.0092 0.0081 0.0081
Loa Loa (eye worm) hypothetical protein 0.0484 0.1702 0.1702
Loa Loa (eye worm) TK/INSR protein kinase 0.0821 0.3099 0.3099
Brugia malayi Protein kinase domain containing protein 0.0104 0.0132 0.0132
Schistosoma mansoni growth factor receptor-bound protein 0.0092 0.0081 0.0081
Echinococcus multilocularis NCK adaptor protein 0.0092 0.0081 0.0081
Toxoplasma gondii fructose-bisphospatase II 0.0792 0.2978 1
Schistosoma mansoni tyrosine kinase 0.1176 0.4565 0.4565
Echinococcus granulosus fibroblast growth factor receptor 4 0.0591 0.2145 0.2145
Toxoplasma gondii fructose-bisphospatase I 0.0295 0.0919 0.2869

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.631 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 0.7943 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 6.5131 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] 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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