Detailed information for compound 1639694

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 495.325 | Formula: C23H19BrN4O4
  • H donors: 2 H acceptors: 3 LogP: 4.6 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc2c(ncnc2cc1OC)Oc1ccc(cc1)NC(=O)Nc1cccc(c1)Br
  • InChi: 1S/C23H19BrN4O4/c1-30-20-11-18-19(12-21(20)31-2)25-13-26-22(18)32-17-8-6-15(7-9-17)27-23(29)28-16-5-3-4-14(24)10-16/h3-13H,1-2H3,(H2,27,28,29)
  • InChiKey: SHKVYTQIJOOEMA-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SRC proto-oncogene, non-receptor tyrosine kinase Starlite/ChEMBL References
Homo sapiens platelet-derived growth factor receptor, beta polypeptide Starlite/ChEMBL References
Homo sapiens MET proto-oncogene, receptor tyrosine kinase Starlite/ChEMBL References
Homo sapiens fms-related tyrosine kinase 1 Starlite/ChEMBL References
Homo sapiens Raf-1 proto-oncogene, serine/threonine kinase Starlite/ChEMBL References
Homo sapiens epidermal growth factor receptor Starlite/ChEMBL References
Homo sapiens fms-related tyrosine kinase 4 Starlite/ChEMBL References
Homo sapiens kinase insert domain receptor Starlite/ChEMBL References
Homo sapiens v-kit Hardy-Zuckerman 4 feline sarcoma viral oncogene homolog Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Loa Loa (eye worm) raf kinase Get druggable targets OG5_130459 All targets in OG5_130459
Echinococcus granulosus tyrosine kinase Get druggable targets OG5_127750 All targets in OG5_127750
Brugia malayi SRC-1 Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Receptor tyrosine-protein kinase erbB-2 precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum IPR000494,EGF receptor, L domain,domain-containing Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus multilocularis tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Brugia malayi protein-tyrosine kinase Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Brugia malayi Furin-like cysteine rich region family protein Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Echinococcus multilocularis raf serine:threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum ko:K08892 fyn-related kinase, putative Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum ko:K04365 B-Raf proto-oncogene serine/threonine-protein kinase, putative Get druggable targets OG5_130459 All targets in OG5_130459
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK Get druggable targets OG5_127750 All targets in OG5_127750
Loa Loa (eye worm) TK/EGFR protein kinase Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus multilocularis tyrosine protein kinase Src64B Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Receptor tyrosine-protein kinase erbB-4 precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine protein kinase Src64B Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr Get druggable targets OG5_127750 All targets in OG5_127750
Loa Loa (eye worm) TK protein kinase Get druggable targets OG5_127750 All targets in OG5_127750
Loa Loa (eye worm) SRC-1 Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine protein kinase Lyn Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Proto-oncogene tyrosine-protein kinase FYN, putative Get druggable targets OG5_127750 All targets in OG5_127750
Brugia malayi Raf kinase Get druggable targets OG5_130459 All targets in OG5_130459
Brugia malayi Immunoglobulin I-set domain containing protein Get druggable targets OG5_130320 All targets in OG5_130320
Schistosoma japonicum Proto-oncogene tyrosine-protein kinase Yrk, putative Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine protein kinase HCK Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus macrophage colony stimulating factor 1 receptor Get druggable targets OG5_132967 All targets in OG5_132967
Echinococcus multilocularis Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Loa Loa (eye worm) TK/KIN16 protein kinase Get druggable targets OG5_130320 All targets in OG5_130320
Echinococcus granulosus tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum ko:K05703 proto-oncogene tyrosine-protein kinase Fyn, putative Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Proto-oncogene tyrosine-protein kinase FGR, putative Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase HCK Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus melanoma receptor tyrosine protein kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus tyrosine protein kinase Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Fgr Get druggable targets OG5_127750 All targets in OG5_127750
Loa Loa (eye worm) TK protein kinase Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum IPR006212,Furin-like repeat;IPR009030,Growth factor, receptor,domain-containing Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Tyrosine-protein kinase transforming protein erbB, putative Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus multilocularis epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Loa Loa (eye worm) TKL/RAF/RAF protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum expressed protein Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum ko:K05085 receptor tyrosine-protein kinase erbB-4, putative Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus multilocularis tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus tyrosine protein kinase Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis tyrosine protein kinase Srms Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus raf serine:threonine protein kinase Get druggable targets OG5_130459 All targets in OG5_130459
Onchocerca volvulus Get druggable targets OG5_130320 All targets in OG5_130320
Onchocerca volvulus Tyrosine kinase homolog Get druggable targets OG5_130320 All targets in OG5_130320
Echinococcus multilocularis tyrosine protein kinase Blk Get druggable targets OG5_127750 All targets in OG5_127750
Schistosoma japonicum Proto-oncogene tyrosine-protein kinase FYN, putative Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine protein kinase Blk Get druggable targets OG5_127750 All targets in OG5_127750

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
Loa Loa (eye worm) cytochrome P450 family protein 0.0927 1 1
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0267 0.27 0.5
Schistosoma mansoni vesicular amine transporter 0.0055 0.0362 0.1074
Loa Loa (eye worm) CYP4Cod1 0.0927 1 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Echinococcus granulosus insulin receptor 0.0066 0.0482 0.0667
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0267 0.27 0.5
Schistosoma mansoni tyrosine kinase 0.0105 0.0916 0.3158
Loa Loa (eye worm) plexin A 0.0025 0.0024 0.0024
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Echinococcus granulosus tyrosine kinase 0.0049 0.0297 0.0411
Echinococcus granulosus tyrosine protein kinase HCK 0.0045 0.0247 0.0341
Echinococcus multilocularis hemicentin 1 0.0029 0.0076 0.0278
Echinococcus multilocularis epidermal growth factor receptor 0.0189 0.1838 0.6715
Echinococcus granulosus roundabout 2 0.0029 0.0076 0.0105
Brugia malayi Furin-like cysteine rich region family protein 0.0189 0.1838 0.1838
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0049 0.0297 0.1085
Schistosoma mansoni tyrosine kinase 0.0066 0.0482 0.1528
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0665 0.7103 0.7103
Schistosoma mansoni tyrosine kinase 0.0189 0.1838 0.6622
Loa Loa (eye worm) raf kinase 0.026 0.2631 0.2631
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0267 0.27 0.5
Brugia malayi Peroxidasin 0.0029 0.0076 0.0076
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0054 0.0346 0.1264
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0927 1 1
Echinococcus granulosus defective proboscis extension response 0.0055 0.0362 0.05
Brugia malayi Cytochrome P450 family protein 0.0267 0.27 0.27
Echinococcus multilocularis plexin a4 0.0025 0.0024 0.0087
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0267 0.27 0.5
Loa Loa (eye worm) TKL/RAF/RAF protein kinase 0.0157 0.1484 0.1484
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Echinococcus granulosus neuroglian 0.0029 0.0076 0.0105
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0267 0.27 0.5
Mycobacterium leprae putative cytochrome p450 0.0267 0.27 0.5
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0267 0.27 0.5
Mycobacterium leprae Conserved hypothetical protein 0.0267 0.27 0.5
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0029 0.0076 0.0076
Echinococcus granulosus epidermal growth factor receptor 0.0105 0.0916 0.1267
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0029 0.0076 0.0278
Schistosoma mansoni serine/threonine protein kinase 0.027 0.2737 1
Echinococcus granulosus raf serine:threonine protein kinase 0.027 0.2737 0.3785
Loa Loa (eye worm) cytochrome P450 0.0267 0.27 0.27
Echinococcus multilocularis tyrosine protein kinase Src42A 0.004 0.0191 0.0696
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Echinococcus multilocularis tyrosine protein kinase HCK 0.0045 0.0247 0.0901
Echinococcus multilocularis raf serine:threonine protein kinase 0.027 0.2737 1
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0267 0.27 0.5
Echinococcus granulosus twitchin 0.0068 0.0505 0.0698
Loa Loa (eye worm) hypothetical protein 0.066 0.7051 0.7051
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0055 0.0362 0.1074
Onchocerca volvulus 0.0583 0.6204 0.9609
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0267 0.27 0.5
Echinococcus granulosus tyrosine protein kinase Blk 0.0049 0.0297 0.0411
Echinococcus granulosus tyrosine protein kinase otk 0.0029 0.0076 0.0105
Echinococcus granulosus tyrosine protein kinase Src42A 0.0054 0.0346 0.0478
Schistosoma mansoni tyrosine kinase 0.0039 0.0182 0.04
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Brugia malayi Prion-like- 0.0029 0.0076 0.0076
Schistosoma mansoni hypothetical protein 0.0267 0.27 0.9859
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0055 0.0362 0.1074
Echinococcus granulosus neuroglian 0.0068 0.0505 0.0698
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0066 0.0482 0.1763
Schistosoma mansoni tyrosine kinase 0.0105 0.0916 0.3158
Echinococcus granulosus plexin a4 0.0025 0.0024 0.0033
Trypanosoma brucei cytochrome P450, putative 0.0927 1 1
Schistosoma mansoni nephrin 0.0068 0.0505 0.1611
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0054 0.0346 0.1264
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0029 0.0076 0.0278
Echinococcus multilocularis 0.0056 0.0367 0.1342
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0029 0.0076 0.0076
Trypanosoma cruzi cytochrome P450, putative 0.0927 1 1
Schistosoma mansoni cytochrome P450 0.0267 0.27 0.9859
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0267 0.27 0.5
Echinococcus multilocularis roundabout 2 0.0085 0.0687 0.251
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0054 0.0346 0.0478
Echinococcus multilocularis tyrosine protein kinase Srms 0.0049 0.0297 0.1085
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0267 0.27 0.5
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0055 0.0362 0.1322
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Loa Loa (eye worm) TK protein kinase 0.0049 0.0297 0.0297
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0267 0.27 0.5
Brugia malayi Raf kinase 0.0261 0.2636 0.2636
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0029 0.0076 0.0278
Echinococcus granulosus roundabout 2 0.0029 0.0076 0.0105
Loa Loa (eye worm) TK/EGFR protein kinase 0.0189 0.1838 0.1838
Brugia malayi SRC-1 0.0054 0.0346 0.0346
Loa Loa (eye worm) cytochrome P450 family protein 0.0267 0.27 0.27
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Echinococcus granulosus tyrosine protein kinase Fyn 0.0054 0.0346 0.0478
Echinococcus multilocularis epidermal growth factor receptor 0.0105 0.0916 0.3348
Echinococcus granulosus macrophage colony stimulating factor 1 receptor 0.0676 0.7232 1
Echinococcus granulosus contactin 0.0029 0.0076 0.0105
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0267 0.27 0.5
Brugia malayi hypothetical protein 0.0055 0.0362 0.0362
Echinococcus granulosus tyrosine protein kinase Src64B 0.0054 0.0346 0.0478
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0029 0.0076 0.0076
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0267 0.27 0.5
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0029 0.0076 0.0105
Echinococcus multilocularis Immunoglobulin 0.0055 0.0362 0.1322
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0267 0.27 0.5
Loa Loa (eye worm) hypothetical protein 0.0085 0.0687 0.0687
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0029 0.0076 0.0278
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0066 0.0482 0.0667
Schistosoma mansoni tyrosine kinase 0.0066 0.0482 0.1528
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0054 0.0346 0.0478
Schistosoma mansoni cell adhesion molecule 0.0072 0.0544 0.176
Echinococcus granulosus lachesin 0.0029 0.0076 0.0105
Echinococcus multilocularis neuroglian 0.0068 0.0505 0.1844
Schistosoma mansoni tyrosine kinase 0.0054 0.0346 0.1015
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Loa Loa (eye worm) hypothetical protein 0.0085 0.0687 0.0687
Echinococcus granulosus tyrosine protein kinase Src42A 0.004 0.0191 0.0264
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0049 0.0297 0.0411
Echinococcus granulosus roundabout 2 0.0085 0.0687 0.095
Echinococcus multilocularis Immunoglobulin 0.0055 0.0362 0.1322
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0054 0.0346 0.1264
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Brugia malayi Cytochrome P450 family protein 0.0267 0.27 0.27
Brugia malayi protein-tyrosine kinase 0.0049 0.0297 0.0297
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0054 0.0346 0.1264
Loa Loa (eye worm) TK protein kinase 0.0045 0.0247 0.0247
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0267 0.27 0.5
Echinococcus multilocularis neuroglian 0.0029 0.0076 0.0278
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Loa Loa (eye worm) SRC-1 0.0054 0.0346 0.0346
Echinococcus granulosus tyrosine protein kinase Lyn 0.0054 0.0346 0.0478
Echinococcus granulosus hemicentin 1 0.0029 0.0076 0.0105
Echinococcus granulosus peroxidasin 0.0029 0.0076 0.0105
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0105 0.0916 0.1267
Echinococcus granulosus tyrosine protein kinase Fyn 0.0054 0.0346 0.0478
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0054 0.0346 0.1264
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Leishmania major cytochrome p450-like protein 0.0927 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0927 1 1
Echinococcus granulosus Immunoglobulin 0.0055 0.0362 0.05
Schistosoma mansoni tyrosine kinase 0.0096 0.081 0.2758
Brugia malayi cytochrome P450 0.0267 0.27 0.27
Schistosoma mansoni tyrosine kinase 0.0054 0.0346 0.1015
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0267 0.27 0.5
Brugia malayi Immunoglobulin I-set domain containing protein 0.0665 0.7103 0.7103
Echinococcus multilocularis roundabout 2 0.0029 0.0076 0.0278
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0054 0.0346 0.1264
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0267 0.27 0.5
Echinococcus multilocularis lachesin 0.0029 0.0076 0.0278
Echinococcus granulosus epidermal growth factor receptor 0.0189 0.1838 0.2542
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0267 0.27 0.5
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0267 0.27 0.5
Echinococcus multilocularis 0.0267 0.27 0.9863
Entamoeba histolytica protein kinase, putative 0.0045 0.0247 0.5
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0054 0.0346 0.1264
Schistosoma mansoni tyrosine kinase 0.0096 0.081 0.2758
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0029 0.0076 0.0076
Echinococcus granulosus cytochrome P450 2K1 0.0267 0.27 0.3733
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0054 0.0346 0.1264
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0267 0.27 0.5
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0054 0.0346 0.1264
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0076 0.0076
Loa Loa (eye worm) hypothetical protein 0.0072 0.0544 0.0544
Loa Loa (eye worm) hypothetical protein 0.0055 0.0362 0.0362
Loa Loa (eye worm) TK/INSR protein kinase 0.0066 0.0482 0.0482
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0029 0.0076 0.0278
Echinococcus multilocularis hemicentin 1 0.0029 0.0076 0.0278
Toxoplasma gondii cytochrome p450 superfamily protein 0.0267 0.27 0.5
Brugia malayi Fibronectin type III domain containing protein 0.0055 0.0362 0.0362
Echinococcus multilocularis insulin receptor 0.0066 0.0482 0.1763
Loa Loa (eye worm) hypothetical protein 0.0029 0.0076 0.0076
Schistosoma mansoni tyrosine kinase 0.0096 0.081 0.2758
Brugia malayi plexin A 0.0025 0.0024 0.0024
Trypanosoma cruzi cytochrome P450, putative 0.0927 1 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0055 0.0362 0.0362
Echinococcus multilocularis roundabout 2 0.0029 0.0076 0.0278
Echinococcus multilocularis tyrosine protein kinase otk 0.0029 0.0076 0.0278
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0072 0.0544 0.0753
Echinococcus multilocularis peroxidasin 0.0029 0.0076 0.0278
Brugia malayi Cytochrome P450 family protein 0.0927 1 1
Echinococcus multilocularis tyrosine protein kinase Blk 0.0049 0.0297 0.1085
Echinococcus granulosus tyrosine protein kinase Fyn 0.0054 0.0346 0.0478
Brugia malayi Protein kinase domain containing protein 0.0066 0.0482 0.0482
Onchocerca volvulus Tyrosine kinase homolog 0.0606 0.6453 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 5 nM Inhibition of PDGFR-beta (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 6 nM Inhibition of human recombinant VEGFR-2 after 1 hr using [gamma-32P]ATP ChEMBL. 26526740
IC50 (binding) = 9 nM Inhibition of VEGFR3 (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 16 nM Inhibition of c-Kit (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 46 nM Inhibition of VEGFR1 (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 930 nM Inhibition of Raf (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 2310 nM Inhibition of c-MET (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) = 5470 nM Inhibition of Src (unknown origin) by radiometric protein kinase assay ChEMBL. 26526740
IC50 (binding) > 10000 nM Inhibition of human EGFR after 1 hr using [gamma-32P]ATP ChEMBL. 26526740
IC50 (binding) = 0.006 uM Inhibition of recombinant human VEGFR-2 using poly(Glu4/Tyr) and [gamma32P]ATP as substrate after 1 hr by scintillation counting ChEMBL. 22229669
IC50 (functional) = 9.1 uM Antiproliferative activity against human HT-29 cells after 72 hrs by MTS assay ChEMBL. 22229669
IC50 (binding) > 10 uM Inhibition of human EGFR expressed in human A431 cells using poly(Glu4/Tyr) and [gamma32P]ATP as substrate after 1 hr by scintillation counting ChEMBL. 22229669
Inhibition (functional) = 35 % Antiproliferative activity against human PC3 cells at 10 uM after 72 hrs by MTS assay ChEMBL. 22229669

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 22229669

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

2 literature references were collected for this gene.

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