Detailed information for compound 1177380

Basic information

Technical information
  • TDR Targets ID: 1177380
  • Name: N-[6-[2-[(2-chloro-6-methylphenyl)amino]benzi midazol-1-yl]pyrimidin-4-yl]-5-methyl-N'-(2-m orpholin-4-ylethyl)pyrimidine-4,6-diamine
  • MW: 571.076 | Formula: C29H31ClN10O
  • H donors: 3 H acceptors: 5 LogP: 5.41 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: Cc1c(ncnc1NCCN1CCOCC1)Nc1ncnc(c1)n1c(Nc2c(C)cccc2Cl)nc2c1cccc2
  • InChi: 1S/C29H31ClN10O/c1-19-6-5-7-21(30)26(19)38-29-36-22-8-3-4-9-23(22)40(29)25-16-24(32-17-33-25)37-28-20(2)27(34-18-35-28)31-10-11-39-12-14-41-15-13-39/h3-9,16-18H,10-15H2,1-2H3,(H,36,38)(H2,31,32,33,34,35,37)
  • InChiKey: YBWMFEGKCNSVBL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[6-[2-[(2-chloro-6-methyl-phenyl)amino]benzimidazol-1-yl]pyrimidin-4-yl]-5-methyl-N'-(2-morpholinoethyl)pyrimidine-4,6-diamine
  • N-[6-[2-[(2-chloro-6-methylphenyl)amino]-1-benzimidazolyl]-4-pyrimidinyl]-5-methyl-N'-(2-morpholinoethyl)pyrimidine-4,6-diamine
  • [6-[[6-[2-[(2-chloro-6-methyl-phenyl)amino]benzimidazol-1-yl]pyrimidin-4-yl]amino]-5-methyl-pyrimidin-4-yl]-(2-morpholinoethyl)amine
  • N-[6-[2-[(2-chloro-6-methyl-phenyl)amino]benzimidazol-1-yl]pyrimidin-4-yl]-5-methyl-N'-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens LCK proto-oncogene, Src family tyrosine kinase 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 methyl-cpg binding protein mbd 0.0033 0.0379 0.1027
Trypanosoma cruzi methionyl-tRNA synthetase, putative 0.0264 0.3693 1
Schistosoma mansoni synaptojanin 0.0011 0.0061 0.0164
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0638 0.0638
Loa Loa (eye worm) SRC-1 0.001 0.0046 0.0125
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0056 0.07 0.1761
Brugia malayi Smad1 0.0016 0.0125 0.0339
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Schistosoma mansoni blooms syndrome DNA helicase 0.0011 0.0062 0.0168
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0022 0.0219 0.0437
Brugia malayi Calcitonin receptor-like protein seb-1 0.0088 0.1168 0.3164
Trypanosoma cruzi ISWI complex protein 0.003 0.033 0.0741
Brugia malayi Latrophilin receptor protein 2 0.0028 0.0301 0.0814
Loa Loa (eye worm) hypothetical protein 0.0011 0.0061 0.0164
Schistosoma mansoni zinc finger protein 0.0038 0.045 0.122
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0061 0.0013
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0046 0.0081
Schistosoma mansoni nocturnin 0.0011 0.0061 0.0164
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.001 0.0046 0.0046
Loa Loa (eye worm) latrophilin receptor protein 2 0.0028 0.0301 0.0814
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0011 0.0061 0.0061
Brugia malayi hypothetical protein 0.0023 0.0228 0.0617
Echinococcus granulosus regulator of G protein signaling 7 0.0008 0.0009 0.0017
Brugia malayi MH1 domain containing protein 0.0009 0.0024 0.0065
Toxoplasma gondii exonuclease III APE 0.0056 0.07 0.1875
Echinococcus granulosus Smad4 0.0016 0.0125 0.0221
Schistosoma mansoni methionine-tRNA synthetase 0.0101 0.1347 0.3648
Plasmodium falciparum ataxin-2 like protein, putative 0.0023 0.0228 0.046
Giardia lamblia Methionyl-tRNA synthetase 0.0264 0.3693 1
Echinococcus multilocularis tyrosine protein kinase Src64B 0.001 0.0046 0.0046
Echinococcus granulosus geminin 0.0183 0.2529 0.447
Echinococcus multilocularis geminin 0.0183 0.2529 0.2529
Echinococcus granulosus fetal alzheimer antigen falz 0.0044 0.0534 0.0944
Schistosoma mansoni adapter molecule crk 0.0009 0.0028 0.0075
Echinococcus multilocularis tyrosine protein kinase Fgr 0.001 0.0046 0.0046
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0056 0.07 0.499
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Trichomonas vaginalis ap endonuclease, putative 0.0056 0.07 0.1761
Echinococcus granulosus methionine tRNA synthetase 0.0264 0.3693 0.6525
Loa Loa (eye worm) hypothetical protein 0.0033 0.0379 0.1027
Echinococcus multilocularis methionine tRNA synthetase 0.0264 0.3693 0.3693
Loa Loa (eye worm) hypothetical protein 0.0084 0.1101 0.298
Treponema pallidum methionyl-tRNA synthetase 0.0101 0.1347 1
Schistosoma mansoni hypothetical protein 0.004 0.048 0.13
Plasmodium vivax methionine--tRNA ligase, putative 0.0264 0.3693 1
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0033 0.0379 0.0379
Loa Loa (eye worm) hypothetical protein 0.0008 0.0019 0.0052
Brugia malayi Bloom's syndrome protein homolog 0.0022 0.0219 0.0594
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0088 0.1168 0.3164
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0008 0.0009 0.0026
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Schistosoma mansoni DNA helicase recq5 0.0022 0.0219 0.0594
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Toxoplasma gondii tRNA ligases class I (M) protein 0.0101 0.1347 0.3631
Echinococcus granulosus tyrosine protein kinase Src42A 0.001 0.0046 0.0081
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0071 0.0911 0.161
Schistosoma mansoni hypothetical protein 0.003 0.033 0.0893
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0046 0.0081
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.001 0.0046 0.0125
Onchocerca volvulus 0.0011 0.0061 0.027
Loa Loa (eye worm) transcription factor SMAD2 0.0231 0.3222 0.8727
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0028 0.0301 0.0531
Brugia malayi PHD-finger family protein 0.0049 0.0601 0.1627
Schistosoma mansoni cript-related 0.0011 0.0061 0.0164
Schistosoma mansoni smad1 5 8 and 0.0016 0.0125 0.0339
Schistosoma mansoni zinc finger protein 0.003 0.033 0.0893
Brugia malayi Sex muscle abnormal protein 5 0.0009 0.0028 0.0075
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) 0.0264 0.3693 1
Brugia malayi latrophilin 2 splice variant baaae 0.006 0.0767 0.2076
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0056 0.07 0.1896
Loa Loa (eye worm) bromodomain containing protein 0.0035 0.0397 0.1074
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0022 0.0219 0.0437
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0071 0.0911 0.0911
Loa Loa (eye worm) tyrosyl-tRNA synthetase 0.0163 0.2244 0.6078
Echinococcus multilocularis c src tyrosine kinase 0.001 0.0046 0.0046
Leishmania major methionyl-tRNA synthetase, putative 0.0264 0.3693 1
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.001 0.0046 0.0046
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0022 0.0219 0.057
Mycobacterium ulcerans methionyl-tRNA synthetase 0.0264 0.3693 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.0638 0.1729
Schistosoma mansoni tyrosine kinase 0.001 0.0046 0.0125
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0062 0.0004
Brugia malayi methionyl-tRNA synthetase 0.0101 0.1347 0.3648
Echinococcus granulosus TGF beta signal transducer SmadC 0.0016 0.0125 0.0221
Echinococcus granulosus segment polarity protein dishevelled 0.0008 0.0009 0.0017
Trichomonas vaginalis ap endonuclease, putative 0.0056 0.07 0.1761
Schistosoma mansoni smad1 5 8 and 0.0016 0.0125 0.0339
Echinococcus granulosus c src tyrosine kinase 0.001 0.0046 0.0081
Schistosoma mansoni fyve finger-containing phosphoinositide kinase fyv1 0.0008 0.0009 0.0026
Echinococcus multilocularis synaptojanin 1 0.0011 0.0061 0.0061
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0008 0.0009 0.0026
Brugia malayi SRC-1 0.001 0.0046 0.0125
Loa Loa (eye worm) hypothetical protein 0.0101 0.1347 0.3648
Loa Loa (eye worm) PHD-finger family protein 0.004 0.048 0.13
Leishmania major hypothetical protein, conserved 0.003 0.033 0.0741
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0056 0.07 0.1761
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0056 0.07 0.1772
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0117 0.1581 0.2794
Entamoeba histolytica sphingomyelinase C precursor, putative 0.0011 0.0061 0.0036
Schistosoma mansoni tyrosine kinase 0.001 0.0046 0.0125
Loa Loa (eye worm) hypothetical protein 0.0088 0.1168 0.3164
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Echinococcus granulosus segment polarity protein dishevelled 0.0008 0.0009 0.0017
Trypanosoma cruzi ISWI complex protein 0.003 0.033 0.0741
Schistosoma mansoni smad1 5 8 and 0.0016 0.0125 0.0339
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0046 0.0046
Onchocerca volvulus Segment polarity protein dishevelled homolog 0.0008 0.0009 0.0042
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0046 0.0046
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.001 0.0046 0.0046
Toxoplasma gondii methionyl-tRNA synthetase 0.0264 0.3693 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0009 0.0026
Brugia malayi exodeoxyribonuclease III family protein 0.0056 0.07 0.1896
Echinococcus granulosus Pleckstrin G protein interacting region 0.0008 0.0009 0.0017
Loa Loa (eye worm) hypothetical protein 0.0157 0.2148 0.5816
Schistosoma mansoni hypothetical protein 0.0183 0.2529 0.685
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0011 0.0062 0.0017
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0056 0.07 0.1761
Echinococcus multilocularis inositol polyphosphate 5 phosphatase OCRL 1 0.0011 0.0061 0.0061
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0009 0.0028 0.0075
Echinococcus granulosus synaptojanin 1 0.0011 0.0061 0.0107
Echinococcus multilocularis segment polarity protein dishevelled 0.0008 0.0009 0.0009
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0638 0.1128
Loa Loa (eye worm) hypothetical protein 0.0011 0.0062 0.0168
Schistosoma mansoni neutral sphingomyelinase 0.0011 0.0061 0.0164
Schistosoma mansoni hypothetical protein 0.0028 0.0301 0.0814
Echinococcus granulosus tyrosine protein kinase Fyn 0.001 0.0046 0.0081
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.001 0.0046 0.0081
Echinococcus multilocularis neutral sphingomyelinase 0.0011 0.0061 0.0061
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Loa Loa (eye worm) hypothetical protein 0.0023 0.0228 0.0617
Echinococcus granulosus smad 0.0016 0.0125 0.0221
Echinococcus granulosus tyrosine protein kinase Btk29A 0.001 0.0046 0.0081
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0061 0.0036
Echinococcus multilocularis smad 0.0016 0.0125 0.0125
Schistosoma mansoni bromodomain containing protein 0.0008 0.0019 0.0052
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0028 0.0301 0.0531
Plasmodium vivax methionine--tRNA ligase, putative 0.0101 0.1347 0.355
Trypanosoma cruzi PAB1-binding protein , putative 0.0023 0.0228 0.046
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0379 0.067
Echinococcus granulosus mothers against decapentaplegic 5 0.0016 0.0125 0.0221
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0044 0.0534 0.1446
Schistosoma mansoni DNA helicase recq1 0.0022 0.0219 0.0594
Plasmodium falciparum methionine--tRNA ligase 0.0264 0.3693 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0009 0.0026
Brugia malayi protein ZK524.3 0.0101 0.1347 0.3648
Brugia malayi MH1 domain containing protein 0.0016 0.0125 0.0339
Echinococcus multilocularis neuropeptide s receptor 0.0401 0.5659 0.5659
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0638 0.1729
Loa Loa (eye worm) hypothetical protein 0.0101 0.1347 0.3648
Echinococcus granulosus tyrosine protein kinase Lyn 0.001 0.0046 0.0081
Schistosoma mansoni smad 0.0016 0.0125 0.0339
Echinococcus multilocularis tyrosine protein kinase Src42A 0.001 0.0046 0.0046
Echinococcus multilocularis GPCR, family 2 0.0028 0.0301 0.0301
Echinococcus granulosus neuropeptide s receptor 0.0401 0.5659 1
Leishmania major leucyl-tRNA synthetase, putative 0.0101 0.1347 0.3542
Brugia malayi MH2 domain containing protein 0.0231 0.3222 0.8727
Treponema pallidum exodeoxyribonuclease (exoA) 0.0056 0.07 0.4972
Echinococcus granulosus bloom syndrome protein 0.0022 0.0219 0.0387
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0061 0.0164
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0011 0.0062 0.0143
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0379 0.1027
Schistosoma mansoni tyrosine kinase 0.001 0.0046 0.0125
Loa Loa (eye worm) hypothetical protein 0.0028 0.0301 0.0814
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0022 0.0219 0.0387
Schistosoma mansoni hypothetical protein 0.0028 0.0301 0.0814
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0011 0.0061 0.0107
Wolbachia endosymbiont of Brugia malayi leucyl-tRNA synthetase 0.0101 0.1347 0.2161
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0022 0.0219 0.0594
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0379 0.0379
Loa Loa (eye worm) hypothetical protein 0.0009 0.0028 0.0075
Echinococcus multilocularis deoxyribonuclease 1 2 0.0011 0.0061 0.0061
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.001 0.0046 0.0082
Giardia lamblia Leucyl-tRNA synthetase 0.0101 0.1347 0.3542
Echinococcus multilocularis zinc finger protein 0.0038 0.045 0.045
Schistosoma mansoni synaptojanin 0.0011 0.0061 0.0164
Echinococcus granulosus GPCR family 2 0.0028 0.0301 0.0531
Echinococcus granulosus methyl CpG binding domain protein 2 0.0033 0.0379 0.067
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Echinococcus multilocularis mothers against decapentaplegic 5 0.0016 0.0125 0.0125
Chlamydia trachomatis leucine--tRNA ligase 0.0101 0.1347 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0.0061 0.0164
Echinococcus granulosus CCR4 NOT transcription complex subunit 6 0.0011 0.0061 0.0107
Echinococcus multilocularis segment polarity protein dishevelled 0.0008 0.0009 0.0009
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0056 0.07 0.1761
Onchocerca volvulus 0.0011 0.0061 0.027
Schistosoma mansoni nck2/grb4 0.0009 0.0028 0.0075
Schistosoma mansoni methyl-cpg binding protein mbd 0.0033 0.0379 0.1027
Echinococcus multilocularis leucyl tRNA synthetase 0.0101 0.1347 0.1347
Brugia malayi MH1 domain containing protein 0.0009 0.0024 0.0065
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0061 0.0164
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0009 0.0028 0.0075
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0117 0.1581 0.1581
Treponema pallidum ATP-dependent DNA helicase 0.0011 0.0062 0.0012
Loa Loa (eye worm) MH2 domain-containing protein 0.0016 0.0125 0.0339
Echinococcus multilocularis methionyl tRNA synthetase, cytoplasmic 0.0101 0.1347 0.1347
Brugia malayi Domain found in Dishevelled, Egl-10, and Pleckstrin family protein 0.0008 0.0009 0.0026
Loa Loa (eye worm) hypothetical protein 0.0011 0.0061 0.0164
Loa Loa (eye worm) hypothetical protein 0.0011 0.0061 0.0164
Brugia malayi regulator of G-protein signaling egl-10 0.0008 0.0009 0.0026
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0016 0.0125 0.0339
Brugia malayi Variant SH3 domain containing protein 0.0009 0.0028 0.0075
Brugia malayi MH1 domain containing protein 0.0016 0.0125 0.0339
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0022 0.0219 0.0219
Schistosoma mansoni tyrosine kinase 0.001 0.0046 0.0125
Plasmodium vivax hypothetical protein, conserved 0.0101 0.1347 0.355
Loa Loa (eye worm) Smad1 0.0016 0.0125 0.0339
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.001 0.0046 0.0046
Plasmodium vivax endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0061 0.0013
Brugia malayi Bromodomain containing protein 0.0147 0.2012 0.5449
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0061 0.0164
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase 0.0264 0.3693 1
Echinococcus multilocularis NCK adaptor protein 0.0009 0.0028 0.0028
Echinococcus granulosus NCK adaptor protein 0.0009 0.0028 0.0049
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0638 0.1729
Schistosoma mansoni ocrl type II inositol 5-phosphatase 0.0011 0.0061 0.0164
Loa Loa (eye worm) MH2 domain-containing protein 0.0231 0.3222 0.8727
Echinococcus granulosus traf and tnf receptor associated protein 0.0011 0.0061 0.0107
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0028 0.0301 0.0301
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.001 0.0046 0.0081
Entamoeba histolytica inositol polyphosphate 5-phosphatase, putative 0.0011 0.0061 0.0036
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0022 0.0219 0.0437
Loa Loa (eye worm) RecQ helicase 0.0022 0.0219 0.0594
Plasmodium vivax exodeoxyribonuclease III, putative 0.0011 0.0061 0.0013
Brugia malayi hypothetical protein 0.0008 0.0009 0.0026
Schistosoma mansoni hypothetical protein 0.0011 0.0061 0.0164
Brugia malayi Variant SH3 domain containing protein 0.0009 0.0028 0.0075
Brugia malayi DIX domain containing protein 0.0008 0.0009 0.0026
Trypanosoma brucei methionyl-tRNA synthetase, putative 0.0264 0.3693 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0016 0.0125 0.0339
Giardia lamblia Sgs1 DNA helicase, putative 0.0022 0.0219 0.0437
Plasmodium vivax hypothetical protein, conserved 0.0011 0.0061 0.0013
Loa Loa (eye worm) hypothetical protein 0.0008 0.0009 0.0026
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.001 0.0046 0.0046
Echinococcus multilocularis tyrosine protein kinase Abl 0.001 0.0046 0.0046
Entamoeba histolytica endonuclease/exonuclease/phosphatase domain containing protein 0.0011 0.0061 0.0036
Trypanosoma brucei ISWI complex protein 0.003 0.033 0.0741
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0011 0.0056 0.0126
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0044 0.0534 0.0534
Schistosoma mansoni growth factor receptor-bound protein 0.0009 0.0028 0.0075
Trichomonas vaginalis DNA helicase recq, putative 0.0022 0.0219 0.0437
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0056 0.07 0.1761
Loa Loa (eye worm) DIX domain-containing protein 0.0008 0.0009 0.0026
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Schistosoma mansoni dishevelled 0.0008 0.0009 0.0026
Trichomonas vaginalis DNA helicase recq, putative 0.0022 0.0219 0.0437
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.0638 0.1729
Entamoeba histolytica inositol polyphosphate-5-phosphatase, putative 0.0011 0.0061 0.0036
Trypanosoma brucei PAB1-binding protein , putative 0.0023 0.0228 0.046
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0056 0.07 0.1761
Entamoeba histolytica recQ family helicase, putative 0.0022 0.0219 0.1265
Schistosoma mansoni hypothetical protein 0.0028 0.0301 0.0814
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0379 0.1027
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0061 0.0164
Brugia malayi N-terminal motif family protein 0.0157 0.2148 0.5816
Treponema pallidum leucyl-tRNA synthetase 0.0101 0.1347 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0022 0.0219 0.0437
Loa Loa (eye worm) hypothetical protein 0.0022 0.0219 0.0594
Echinococcus granulosus zinc finger protein 0.0038 0.045 0.0796
Schistosoma mansoni hypothetical protein 0.006 0.0767 0.2076
Echinococcus granulosus growth factor receptor bound protein 2 0.0009 0.0028 0.0049
Trichomonas vaginalis DNA helicase recq1, putative 0.0022 0.0219 0.0437
Loa Loa (eye worm) nuclear factor I 0.0009 0.0024 0.0065
Entamoeba histolytica recQ family DNA helicase 0.0011 0.0062 0.0048
Brugia malayi hypothetical protein 0.0015 0.0111 0.0301
Echinococcus multilocularis Pleckstrin G protein, interacting region 0.0008 0.0009 0.0009
Brugia malayi methionyl-tRNA synthetase 0.0264 0.3693 1
Echinococcus granulosus tyrosine protein kinase Src64B 0.001 0.0046 0.0081
Schistosoma mansoni hypothetical protein 0.0028 0.0301 0.0814
Loa Loa (eye worm) hypothetical protein 0.0101 0.1347 0.3648
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Loa Loa (eye worm) hypothetical protein 0.0075 0.098 0.2654
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Schistosoma mansoni carbon catabolite repressor protein 0.0011 0.0061 0.0164
Schistosoma mansoni dishevelled 0.0008 0.0009 0.0026
Echinococcus multilocularis growth factor receptor bound protein 2 0.0009 0.0028 0.0028
Onchocerca volvulus 0.0008 0.0009 0.0042
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0638 0.1128
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Schistosoma mansoni ap endonuclease 0.0056 0.07 0.1896
Onchocerca volvulus 0.0163 0.2244 1
Loa Loa (eye worm) hypothetical protein 0.0139 0.1892 0.5123
Entamoeba histolytica methionyl-tRNA synthetase, putative 0.0101 0.1347 1
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0016 0.0125 0.0125
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0056 0.07 0.1237
Echinococcus multilocularis regulator of G protein signaling 7 0.0008 0.0009 0.0009
Schistosoma mansoni growth factor receptor-bound protein 0.0009 0.0028 0.0075
Mycobacterium leprae Probable methionyl-tRNA synthase MetS 0.0264 0.3693 0.5
Loa Loa (eye worm) hypothetical protein 0.006 0.0767 0.2076
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0638 0.0638
Schistosoma mansoni blooms syndrome DNA helicase 0.0011 0.0056 0.0151
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Loa Loa (eye worm) endonuclease/Exonuclease/phosphatase 0.0011 0.0061 0.0164
Entamoeba histolytica endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0036
Brugia malayi Tyrosine-protein kinase abl-1 0.001 0.0046 0.0125
Loa Loa (eye worm) CCR4-NOT transcription complex subunit 6 family protein 0.0011 0.0061 0.0164
Schistosoma mansoni hypothetical protein 0.001 0.0046 0.0125
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0011 0.0062 0.0004
Toxoplasma gondii LsmAD domain-containing protein 0.0023 0.0228 0.0593
Loa Loa (eye worm) hypothetical protein 0.008 0.1047 0.2835
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0264 0.3693 1
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0009 0.0028 0.0075
Brugia malayi Bromodomain containing protein 0.0075 0.0978 0.2649
Echinococcus multilocularis traf and tnf receptor associated protein 0.0011 0.0061 0.0061
Brugia malayi CCR4 0.0011 0.0061 0.0164
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0022 0.0219 0.0387
Echinococcus multilocularis Smad4 0.0016 0.0125 0.0125
Schistosoma mansoni Smad4 0.0016 0.0125 0.0339
Schistosoma mansoni leucyl-tRNA synthetase 0.0101 0.1347 0.3648
Echinococcus multilocularis tyrosine protein kinase Fyn 0.001 0.0046 0.0046
Echinococcus multilocularis bloom syndrome protein 0.0022 0.0219 0.0219
Trypanosoma cruzi PAB1-binding protein , putative 0.0023 0.0228 0.046
Loa Loa (eye worm) hypothetical protein 0.0011 0.0062 0.0168
Schistosoma mansoni dep domain containing protein 0.0008 0.0009 0.0026
Echinococcus granulosus neutral sphingomyelinase 0.0011 0.0061 0.0107
Toxoplasma gondii endonuclease/exonuclease/phosphatase family protein 0.0011 0.0061 0.0139
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0028 0.0301 0.0301
Schistosoma mansoni bromodomain containing protein 0.0124 0.1682 0.4555
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0022 0.0219 0.0594
Echinococcus multilocularis neuropeptide receptor A26 0.0401 0.5659 0.5659
Leishmania major hypothetical protein, conserved 0.0023 0.0228 0.046
Echinococcus granulosus methionyl tRNA synthetase cytoplasmic 0.0101 0.1347 0.238
Echinococcus multilocularis CCR4 NOT transcription complex subunit 6 0.0011 0.0061 0.0061
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0022 0.0219 0.057
Schistosoma mansoni regulator of G protein signaling 0.0008 0.0009 0.0026
Schistosoma mansoni z-protein (S1r protein) 0.0008 0.0009 0.0026
Brugia malayi MH2 domain containing protein 0.0016 0.0125 0.0339
Plasmodium falciparum ataxin-2 like protein, putative 0.0023 0.0228 0.046
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0157 0.2148 0.9569
Onchocerca volvulus Putative neutral sphingomyelinase 0.0011 0.0061 0.027
Brugia malayi Endonuclease/Exonuclease/phosphatase family protein 0.0011 0.0061 0.0164
Echinococcus multilocularis regulator of G protein signaling 7 0.0008 0.0009 0.0009
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0056 0.07 0.07
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0088 0.1168 0.3164
Schistosoma mansoni ap endonuclease 0.0056 0.07 0.1896
Brugia malayi hypothetical protein 0.0008 0.0009 0.0026
Plasmodium falciparum methionine--tRNA ligase, putative 0.0101 0.1347 0.3542
Schistosoma mansoni hypothetical protein 0.0183 0.2529 0.685
Schistosoma mansoni methionine-tRNA synthetase 0.0264 0.3693 1
Brugia malayi MH2 domain containing protein 0.0016 0.0125 0.0339
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0022 0.0219 0.0594
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0056 0.07 0.1761
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0028 0.0301 0.0814
Loa Loa (eye worm) hypothetical protein 0.0009 0.0024 0.0065
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0022 0.0219 0.0437
Echinococcus granulosus inositol polyphosphate 5 phosphatase OCRL 1 0.0011 0.0061 0.0107
Mycobacterium ulcerans leucyl-tRNA synthetase 0.0101 0.1347 0.2161
Echinococcus granulosus regulator of G protein signaling 7 0.0008 0.0009 0.0017
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0638 0.1729
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0264 0.3693 1
Plasmodium vivax ataxin-2 like protein, putative 0.0023 0.0228 0.0473
Chlamydia trachomatis methionine--tRNA ligase 0.0101 0.1347 0.5
Echinococcus granulosus neuropeptide receptor A26 0.0401 0.5659 1
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0022 0.0219 0.0219

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.119 uM Inhibition of Lck by lance assay ChEMBL. 18793846
IC50 (binding) = 0.359 uM Inhibition of TEL fused Lck-mediated proliferation of TEL-Lck transformed mouse BA/F3 cells after 48 hrs by bright-glo luciferase assay ChEMBL. 18793846

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

1 literature reference was collected for this gene.

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