Detailed information for compound 111426

Basic information

Technical information
  • TDR Targets ID: 111426
  • Name: 7-tert-butyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d ]pyrimidin-4-amine
  • MW: 358.436 | Formula: C22H22N4O
  • H donors: 1 H acceptors: 2 LogP: 4.31 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1ncnc2c1c(cn2C(C)(C)C)c1ccc(cc1)Oc1ccccc1
  • InChi: 1S/C22H22N4O/c1-22(2,3)26-13-18(19-20(23)24-14-25-21(19)26)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-14H,1-3H3,(H2,23,24,25)
  • InChiKey: MYSJNRWPLKEUQT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 7-tert-butyl-5-(4-phenoxyphenyl)-4-pyrrolo[2,3-d]pyrimidinamine
  • [7-tert-butyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-yl]amine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens LCK proto-oncogene, Src family tyrosine kinase Starlite/ChEMBL References
Homo sapiens SRC proto-oncogene, non-receptor tyrosine kinase Starlite/ChEMBL References
Homo sapiens kinase insert domain receptor Starlite/ChEMBL References
Homo sapiens TEK tyrosine kinase, endothelial Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus granulosus tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Brugia malayi Immunoglobulin I-set domain containing protein Get druggable targets OG5_130320 All targets in OG5_130320
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 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 granulosus tyrosine protein kinase Fyn Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine kinase 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 granulosus tyrosine kinase|tyrosine protein kinase Fyn 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 japonicum ko:K05703 proto-oncogene tyrosine-protein kinase Fyn, putative Get druggable targets OG5_127750 All targets in OG5_127750
Onchocerca volvulus Get druggable targets OG5_130320 All targets in OG5_130320
Schistosoma mansoni tyrosine kinase 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 tyrosine protein kinase Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK Get druggable targets OG5_127750 All targets in OG5_127750
Onchocerca volvulus Tyrosine kinase homolog Get druggable targets OG5_130320 All targets in OG5_130320
Echinococcus multilocularis tyrosine protein kinase Src64B Get druggable targets OG5_127750 All targets in OG5_127750
Entamoeba histolytica protein kinase, putative 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 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
Brugia malayi protein-tyrosine kinase 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
Echinococcus multilocularis tyrosine protein kinase Blk 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 Yrk, putative 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
Echinococcus multilocularis tyrosine protein kinase Fyn 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 Proto-oncogene tyrosine-protein kinase FYN, putative 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 lyn tyrosine protein kinase blk 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
Schistosoma japonicum ko:K08892 fyn-related kinase, 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 multilocularis tyrosine protein kinase Fyn 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
Echinococcus multilocularis tyrosine protein kinase Srms Get druggable targets OG5_127750 All targets in OG5_127750
Echinococcus granulosus tyrosine protein kinase Fyn 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
Echinococcus multilocularis tyrosine protein kinase Fyn 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 Src42A Get druggable targets OG5_127750 All targets in OG5_127750
Loa Loa (eye worm) TK/KIN16 protein kinase Get druggable targets OG5_130320 All targets in OG5_130320
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) hypothetical protein 0.0018 0.0192 0.0191
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Brugia malayi Fibronectin type III domain containing protein 0.0016 0.0129 0.0048
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0018 0.0198 0.0196
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0023 0.035 0.0342
Trichomonas vaginalis mercuric reductase, putative 0.0023 0.035 0.0062
Brugia malayi protein-tyrosine kinase 0.0049 0.1108 0.1035
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0023 0.035 0.1233
Schistosoma mansoni nephrin 0.0018 0.0212 0.1296
Schistosoma mansoni growth factor receptor-bound protein 0.0018 0.0198 0.1208
Brugia malayi Kringle domain containing protein 0.0017 0.0171 0.0091
Brugia malayi Pre-SET motif family protein 0.0034 0.0675 0.0599
Plasmodium falciparum thioredoxin reductase 0.0023 0.035 0.1233
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Plasmodium vivax glutathione reductase, putative 0.0067 0.1624 1
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0339 0.0046
Brugia malayi Protein kinase domain containing protein 0.0126 0.3348 0.3294
Loa Loa (eye worm) hypothetical protein 0.0016 0.0129 0.0127
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0023 0.035 1
Loa Loa (eye worm) SRC-1 0.0058 0.1366 0.1365
Echinococcus granulosus tyrosine protein kinase Src42A 0.0044 0.0966 0.5946
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0023 0.0339 0.2076
Onchocerca volvulus 0.0167 0.4535 0.5912
Loa Loa (eye worm) hypothetical protein 0.0012 0.0013 0.0011
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0023 0.035 0.0342
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0023 0.035 0.2092
Toxoplasma gondii kringle domain-containing protein 0.0017 0.0171 0.1051
Schistosoma mansoni nck2/grb4 0.0018 0.0198 0.1208
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0023 0.035 1
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0339 0.0046
Echinococcus granulosus tyrosine protein kinase Src64B 0.0058 0.1366 0.8412
Echinococcus multilocularis c src tyrosine kinase 0.0023 0.0339 0.208
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0022 0.0305 0.3616
Echinococcus granulosus NCK adaptor protein 0.0018 0.0198 0.1208
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0023 0.035 0.0271
Loa Loa (eye worm) hypothetical protein 0.0126 0.3348 0.3347
Echinococcus granulosus growth factor receptor bound protein 2 0.0018 0.0198 0.1208
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0023 0.035 0.2092
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0023 0.035 0.0342
Entamoeba histolytica recQ family DNA helicase 0.0012 0.0013 0.0153
Treponema pallidum NADH oxidase 0.0023 0.035 1
Onchocerca volvulus Tyrosine kinase homolog 0.0174 0.476 0.6211
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0023 0.035 1
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0017 0.0171 0.1051
Brugia malayi Sex muscle abnormal protein 5 0.0018 0.0198 0.0118
Toxoplasma gondii NADPH-glutathione reductase 0.0023 0.035 0.2155
Brugia malayi Protein kinase domain containing protein 0.0022 0.0312 0.0233
Loa Loa (eye worm) TK/ROR protein kinase 0.0025 0.0396 0.0394
Plasmodium vivax thioredoxin reductase, putative 0.0067 0.1624 1
Mycobacterium tuberculosis Probable oxidoreductase 0.0023 0.035 0.0342
Echinococcus multilocularis tyrosine protein kinase Srms 0.0049 0.1108 0.6818
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0023 0.035 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0109 0.0107
Schistosoma mansoni DNA helicase recq5 0.0023 0.0339 0.2076
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0023 0.035 1
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.1233
Schistosoma mansoni DNA helicase recq1 0.0023 0.0339 0.2076
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0339 0.0257
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0058 0.1366 0.8412
Loa Loa (eye worm) hypothetical protein 0.0018 0.0192 0.0191
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0675 0.4149
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0023 0.035 0.0342
Echinococcus multilocularis tyrosine protein kinase Abl 0.0023 0.0339 0.208
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0305 0.0922
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0023 0.0339 0.2076
Entamoeba histolytica recQ family helicase, putative 0.0023 0.0339 0.4019
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0023 0.0339 0.208
Loa Loa (eye worm) TK protein kinase 0.0049 0.1108 0.1106
Echinococcus multilocularis NCK adaptor protein 0.0018 0.0198 0.1208
Echinococcus granulosus tyrosine protein kinase shark 0.0014 0.0081 0.0486
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0239 0.6651 0.665
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0023 0.035 0.5
Loa Loa (eye worm) hypothetical protein 0.0016 0.0129 0.0127
Schistosoma mansoni hypothetical protein 0.0017 0.0171 0.104
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0339 0.0046
Entamoeba histolytica SH2-protein kinase domain containing protein 0.0014 0.0081 0.0959
Echinococcus multilocularis thioredoxin glutathione reductase 0.0067 0.1624 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.0129 0.0048
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.0014 0.0081 0.0486
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0058 0.1366 0.8412
Trypanosoma cruzi hypothetical protein, conserved 0.0017 0.0171 0.0979
Loa Loa (eye worm) hypothetical protein 0.0034 0.0675 0.0673
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0049 0.1108 0.6818
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0023 0.0339 0.0337
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0339 0.1156
Echinococcus granulosus tyrosine kinase 0.0014 0.0081 0.0486
Echinococcus multilocularis tyrosine protein kinase shark 0.0014 0.0081 0.0486
Loa Loa (eye worm) hypothetical protein 0.0023 0.0339 0.0337
Echinococcus granulosus tyrosine protein kinase Lyn 0.0058 0.1366 0.8412
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0013 0.0079
Plasmodium falciparum glutathione reductase 0.0023 0.035 0.1233
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0675 0.4149
Treponema pallidum exodeoxyribonuclease (exoA) 0.0022 0.0305 0.8659
Echinococcus granulosus tyrosine kinase 0.0049 0.1108 0.6818
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0023 0.035 0.2145
Brugia malayi Thioredoxin reductase 0.0067 0.1624 0.1556
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0022 0.0305 0.1811
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0017 0.0171 0.009
Echinococcus granulosus c src tyrosine kinase 0.0023 0.0339 0.208
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0018 0.0198 0.0196
Trypanosoma cruzi trypanothione reductase, putative 0.0067 0.1624 1
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0023 0.035 0.2155
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0023 0.035 0.1233
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Schistosoma mansoni ap endonuclease 0.0022 0.0305 0.1867
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0022 0.0305 0.1867
Echinococcus granulosus bloom syndrome protein 0.0023 0.0339 0.2076
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0023 0.0339 0.1156
Echinococcus multilocularis growth factor receptor bound protein 2 0.0018 0.0198 0.1208
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0023 0.035 0.2145
Onchocerca volvulus 0.0034 0.0675 0.0789
Echinococcus granulosus tyrosine protein kinase ABL1 0.0014 0.0081 0.0486
Brugia malayi Tyrosine-protein kinase abl-1 0.0023 0.0339 0.0261
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0675 0.4156
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0023 0.035 0.2145
Schistosoma mansoni cell adhesion molecule 0.0019 0.0235 0.1439
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0058 0.1366 0.8412
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0339 0.2022
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0023 0.035 0.2155
Echinococcus granulosus tissue type plasminogen activator 0.0017 0.0171 0.104
Brugia malayi Variant SH3 domain containing protein 0.0018 0.0198 0.0118
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0675 0.4149
Trichomonas vaginalis glutathione reductase, putative 0.0023 0.035 0.0062
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0058 0.1366 0.8412
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0339 0.026
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0169
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0022 0.0305 0.1867
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Loa Loa (eye worm) hypothetical protein 0.0014 0.0081 0.0079
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0675 0.4149
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0638 0.3922
Echinococcus granulosus tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Trypanosoma cruzi trypanothione reductase, putative 0.0023 0.035 0.2092
Loa Loa (eye worm) RecQ helicase 0.0023 0.0339 0.0337
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0023 0.035 0.0342
Brugia malayi Variant SH3 domain containing protein 0.0018 0.0198 0.0118
Schistosoma mansoni blooms syndrome DNA helicase 0.0012 0.0013 0.0067
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0023 0.035 0.0342
Trichomonas vaginalis set domain proteins, putative 0.0272 0.7615 1
Loa Loa (eye worm) TK/ABL protein kinase 0.0014 0.0081 0.0079
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0339 0.026
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Echinococcus granulosus tyrosine protein kinase Blk 0.0049 0.1108 0.6818
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0015 0.0109 0.0659
Echinococcus multilocularis tyrosine protein kinase HCK 0.004 0.0843 0.5183
Entamoeba histolytica protein kinase, putative 0.004 0.0843 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0675 0.4149
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Echinococcus granulosus twitchin 0.0014 0.0086 0.0516
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.1233
Leishmania major trypanothione reductase 0.0067 0.1624 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0305 0.1876
Echinococcus granulosus tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Plasmodium vivax SET domain protein, putative 0.0034 0.0675 0.4156
Plasmodium falciparum glutathione reductase 0.0067 0.1624 1
Schistosoma mansoni tyrosine kinase 0.0058 0.1366 0.8412
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0675 0.4149
Schistosoma mansoni serine/threonine protein kinase 0.0014 0.0074 0.0446
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0058 0.1366 0.8412
Schistosoma mansoni tyrosine kinase 0.0014 0.0081 0.0486
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0023 0.0339 0.1156
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0067 0.1624 1
Loa Loa (eye worm) glutathione reductase 0.0067 0.1624 0.1622
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0675 0.4149
Echinococcus granulosus neuroglian 0.0014 0.0086 0.0516
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0058 0.1366 0.8412
Giardia lamblia Hypothetical protein 0.0354 1 1
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0023 0.035 0.1233
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0049 0.1108 0.6818
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0023 0.035 1
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0339 0.2076
Schistosoma mansoni tyrosine kinase 0.0058 0.1366 0.8412
Echinococcus granulosus thioredoxin glutathione reductase 0.0067 0.1624 1
Schistosoma mansoni tyrosine kinase 0.0023 0.0339 0.208
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0023 0.0339 0.2076
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0022 0.0305 0.0922
Echinococcus granulosus tyrosine protein kinase Fps85D 0.0014 0.0081 0.0486
Brugia malayi glutathione reductase 0.0067 0.1624 0.1556
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0186 0.5111 0.511
Echinococcus multilocularis tyrosine kinase 0.0014 0.0081 0.0486
Toxoplasma gondii thioredoxin reductase 0.0067 0.1624 1
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0017 0.0171 0.009
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0339 0.2085
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Schistosoma mansoni growth factor receptor-bound protein 0.0018 0.0198 0.1208
Onchocerca volvulus 0.0017 0.0171 0.0119
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0023 0.0339 0.208
Loa Loa (eye worm) hypothetical protein 0.0012 0.0013 0.0011
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0018 0.0198 0.1208
Plasmodium falciparum thioredoxin reductase 0.0067 0.1624 1
Echinococcus multilocularis roundabout 2 0.0022 0.0319 0.1955
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0305 0.0226
Echinococcus multilocularis tyrosine protein kinase Blk 0.0049 0.1108 0.6818
Loa Loa (eye worm) TK/FER protein kinase 0.0014 0.0081 0.0079
Loa Loa (eye worm) hypothetical protein 0.0018 0.0198 0.0196
Schistosoma mansoni tyrosine kinase 0.0014 0.0081 0.0486
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0339 0.2085
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0023 0.035 0.2092
Toxoplasma gondii exonuclease III APE 0.0022 0.0305 0.1876
Echinococcus multilocularis tissue type plasminogen activator 0.0017 0.0171 0.104
Echinococcus granulosus tyrosine protein kinase Srms 0.0014 0.0081 0.0486
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0023 0.035 0.2155
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0023 0.035 0.1233
Brugia malayi hypothetical protein 0.0016 0.0129 0.0048
Loa Loa (eye worm) hypothetical protein 0.0016 0.0129 0.0127
Brugia malayi Fibroblast growth factor family protein 0.0354 1 1
Echinococcus granulosus tyrosine protein kinase HCK 0.004 0.0843 0.5183
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0022 0.0305 0.1811
Loa Loa (eye worm) hypothetical protein 0.0354 1 1
Brugia malayi Pre-SET motif family protein 0.0239 0.6651 0.6624
Echinococcus granulosus roundabout 2 0.0022 0.0319 0.1955
Loa Loa (eye worm) thioredoxin reductase 0.0067 0.1624 0.1622
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0014 0.0081 0.0486
Brugia malayi Immunoglobulin I-set domain containing protein 0.0186 0.5111 0.5071
Schistosoma mansoni tyrosine kinase 0.0011 0.0006 0.0026
Giardia lamblia NADH oxidase lateral transfer candidate 0.0023 0.035 0.0047
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0012 0.0013 0.0079
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0023 0.0339 0.026
Schistosoma mansoni tyrosine kinase 0.0023 0.0339 0.208
Loa Loa (eye worm) TK protein kinase 0.004 0.0843 0.0841
Echinococcus multilocularis neuroglian 0.0014 0.0086 0.0516
Giardia lamblia Sgs1 DNA helicase, putative 0.0023 0.0339 0.0035
Schistosoma mansoni adapter molecule crk 0.0018 0.0198 0.1208
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0023 0.035 0.0342
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0058 0.1366 0.8412
Onchocerca volvulus 0.0272 0.7615 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0058 0.1366 0.8412
Echinococcus granulosus tyrosine protein kinase Src42A 0.0058 0.1366 0.8412
Trypanosoma brucei trypanothione reductase 0.0067 0.1624 1
Brugia malayi SRC-1 0.0058 0.1366 0.1296
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0023 0.0339 0.208
Loa Loa (eye worm) hypothetical protein 0.0354 1 1
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0023 0.0339 0.2076
Echinococcus granulosus tyrosine protein kinase Fyn 0.0058 0.1366 0.8412
Schistosoma mansoni ap endonuclease 0.0022 0.0305 0.1867
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0022 0.0305 0.0303
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0044 0.0966 0.5946

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) uM Inhibition of p56 Lck tyrosine kinase catalytic domain at 1 mM ATP (not tested) ChEMBL. 11012021
IC50 (binding) uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) 0 uM Inhibition of p56 Lck tyrosine kinase catalytic domain at 1 mM ATP (not tested) ChEMBL. 11012021
IC50 (binding) 0 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) = 0.002 uM Inhibition of p56 Lck tyrosine kinase at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 0.002 uM Inhibitory activity against p56 Lck tyrosine kinase at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.002 uM Inhibition of p56 Lck tyrosine kinase at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 0.002 uM Inhibitory activity against p56 Lck tyrosine kinase at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.0138 uM Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 0.0138 uM Inhibition of p56 Lck tyrosine kinase catalytic domain at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 0.014 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) = 0.014 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) = 0.075 uM Inhibition of p56 Lck tyrosine kinase at 1 mM ATP ChEMBL. 11012021
IC50 (binding) = 0.075 uM Inhibition of p56 Lck tyrosine kinase, in presence of 1 mM ATP ChEMBL. 11012022
IC50 (binding) = 0.075 uM Inhibition of p56 Lck tyrosine kinase at 1 mM ATP ChEMBL. 11012021
IC50 (binding) = 0.61 uM Inhibition of src at 5 mM ATP ChEMBL. 11012021
IC50 (binding) = 0.61 uM Inhibition of src, in presence of 1 mM ATP ChEMBL. 11012022
IC50 (binding) = 0.61 uM Inhibition of src at 5 mM ATP ChEMBL. 11012021
IC50 (binding) = 2.29 uM Inhibition of Vascular endothelial growth factor receptor 2 at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 2.29 uM Inhibitory activity against vascular endothelial growth factor receptor 2 (VEGFR2) at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 2.29 uM Inhibition of Vascular endothelial growth factor receptor 2 at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 2.29 uM Inhibitory activity against vascular endothelial growth factor receptor 2 (VEGFR2) at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 2.68 uM Inhibition of tie-2 at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 2.68 uM Inhibitory activity against tie-2 at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 2.68 uM Inhibition of tie-2 at 5 uM ATP ChEMBL. 11012021
IC50 (binding) = 2.68 uM Inhibitory activity against tie-2 at a concentration of 5 microM ATP. ChEMBL. 11012022

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

2 literature references were collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.