Detailed information for compound 111085

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 395.456 | Formula: C24H21N5O
  • H donors: 1 H acceptors: 3 LogP: 4.65 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1c(c2ccc(cc2)Oc2ccccc2)c2c(n1C1CCCC1)ncnc2N
  • InChi: 1S/C24H21N5O/c25-14-20-21(16-10-12-19(13-11-16)30-18-8-2-1-3-9-18)22-23(26)27-15-28-24(22)29(20)17-6-4-5-7-17/h1-3,8-13,15,17H,4-7H2,(H2,26,27,28)
  • InChiKey: VMZBKTOJOWBBSN-UHFFFAOYSA-N  


Substructure search Similarity search

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 LCK proto-oncogene, Src family 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
Onchocerca volvulus Get druggable targets OG5_130320 All targets in OG5_130320
Brugia malayi Immunoglobulin I-set domain containing protein Get druggable targets OG5_130320 All targets in OG5_130320
Loa Loa (eye worm) TK/KIN16 protein kinase 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
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
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.144 0.1437
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0302 0.0387
Echinococcus multilocularis c src tyrosine kinase 0.0013 0.0127 0.0124
Brugia malayi Tyrosine-protein kinase abl-1 0.0013 0.0127 0.0158
Brugia malayi Ras-related protein Rac1 0.0012 0.0112 0.014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0027 0.0031
Echinococcus multilocularis Immunoglobulin 0.0011 0.009 0.0087
Echinococcus granulosus roundabout 2 0.0022 0.0393 0.039
Loa Loa (eye worm) hypothetical protein 0.0232 0.6253 0.8009
Leishmania major eukaryotic translation initiation factor-like protein 0.0288 0.7807 1
Schistosoma mansoni vesicular amine transporter 0.0011 0.009 0.0115
Brugia malayi GTP-binding protein, identical 0.0137 0.3595 0.4602
Echinococcus multilocularis Ras C3 botulinum toxin substrate 1 0.0012 0.0112 0.0109
Brugia malayi SRC-1 0.0013 0.0127 0.0158
Trypanosoma brucei Eukaryotic translation initiation factor 4E-1 0.0288 0.7807 1
Echinococcus multilocularis tyrosine protein kinase Abl 0.0013 0.0127 0.0124
Schistosoma mansoni neuroglian 0.0011 0.008 0.0102
Schistosoma mansoni cell adhesion molecule 0.0011 0.008 0.0102
Brugia malayi PXA domain containing protein 0.0019 0.0302 0.0383
Echinococcus granulosus neuroglian 0.0014 0.017 0.0167
Schistosoma mansoni growth factor receptor-bound protein 0.0009 0.0027 0.0035
Brugia malayi hypothetical protein 0.0019 0.0302 0.0383
Schistosoma mansoni cell adhesion molecule 0.0019 0.0313 0.0401
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0034 0.0734 0.0808
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0302 0.0299
Echinococcus multilocularis regulator of G protein signaling 0.0019 0.0302 0.0299
Echinococcus granulosus roundabout 2 0.0011 0.008 0.0077
Echinococcus granulosus NCK adaptor protein 0.0009 0.0027 0.0024
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0011 0.008 0.0077
Echinococcus granulosus twitchin 0.0014 0.017 0.0167
Schistosoma mansoni rac gtpase 0.0012 0.0112 0.0144
Brugia malayi Sex muscle abnormal protein 5 0.0009 0.0027 0.0031
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.6253 0.6252
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Brugia malayi regulator of G-protein signaling rgs-7 0.0019 0.0302 0.0383
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0302 0.0299
Echinococcus multilocularis expressed protein 0.0367 1 1
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-4 0.0034 0.0734 0.0808
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0013 0.0127 0.0124
Echinococcus multilocularis Regulator of G protein signaling 20 0.0019 0.0302 0.0299
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-1 0.0288 0.7807 1
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.144 0.1844
Trypanosoma cruzi eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative 0.0034 0.0734 0.0808
Echinococcus granulosus tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0302 0.0387
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0019 0.0302 0.0383
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Schistosoma mansoni tyrosine kinase 0.001 0.0059 0.0075
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0034 0.0734 0.0808
Brugia malayi hypothetical protein 0.0019 0.0302 0.0383
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0302 0.0299
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0302 0.0299
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0011 0.008 0.0077
Echinococcus granulosus tyrosine protein kinase Src64B 0.0013 0.0127 0.0124
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0009 0.0027 0.0035
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0011 0.009 0.0115
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0302 0.0299
Trichomonas vaginalis hypothetical protein 0.0034 0.0734 0.0808
Loa Loa (eye worm) PXA domain-containing protein 0.0019 0.0302 0.0383
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0302 0.0387
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0734 0.0808
Echinococcus multilocularis roundabout 2 0.0011 0.008 0.0077
Echinococcus granulosus ras C3 botulinum toxin substrate 2 0.0012 0.0112 0.0109
Echinococcus granulosus tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0009 0.0027 0.0031
Schistosoma mansoni tyrosine kinase 0.0013 0.0127 0.0162
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.144 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.144 0.5
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0011 0.008 0.0077
Brugia malayi Variant SH3 domain containing protein 0.0009 0.0027 0.0031
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0302 0.0299
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.144 0.1437
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0302 0.0299
Echinococcus multilocularis ras C3 botulinum toxin substrate 2 0.0012 0.0112 0.0109
Echinococcus multilocularis growth factor receptor bound protein 2 0.0009 0.0027 0.0024
Brugia malayi regulator of G-protein signaling egl-10 0.0019 0.0302 0.0383
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.144 0.5
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0302 0.0387
Brugia malayi eukaryotic translation initiation factor 4E-1 0.0034 0.0734 0.0937
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0302 0.0387
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-4 0.0034 0.0734 0.0808
Onchocerca volvulus 0.0167 0.4424 0.961
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0013 0.0127 0.0124
Loa Loa (eye worm) eukaryotic translation initiation factor 4E-1 0.0034 0.0734 0.0937
Loa Loa (eye worm) eukaryotic translation initiation factor 4E type 3 0.0034 0.0734 0.0937
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0937
Schistosoma mansoni cell polarity protein 0.0137 0.3595 0.4604
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Echinococcus granulosus Immunoglobulin 0.0011 0.009 0.0087
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0013 0.0127 0.0124
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0302 0.0387
Loa Loa (eye worm) hypothetical protein 0.0016 0.0211 0.0266
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0302 0.0383
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Echinococcus multilocularis roundabout 2 0.0022 0.0393 0.039
Loa Loa (eye worm) hypothetical protein 0.0018 0.0272 0.0345
Schistosoma mansoni survival motor neuron protein 0.0047 0.1098 0.1406
Loa Loa (eye worm) hypothetical protein 0.0011 0.009 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.0211 0.0266
Giardia lamblia Translation elongation factor 0.0034 0.0734 1
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0019 0.0302 0.0383
Onchocerca volvulus 0.0012 0.0112 0.0238
Loa Loa (eye worm) hypothetical protein 0.0018 0.0272 0.0345
Brugia malayi GTP-binding protein 0.0137 0.3595 0.4602
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Echinococcus multilocularis neuroglian 0.0014 0.017 0.0167
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0302 0.0387
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Loa Loa (eye worm) hypothetical protein 0.0016 0.0211 0.0266
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-3 0.0034 0.0734 0.0808
Loa Loa (eye worm) hypothetical protein 0.0016 0.0211 0.0266
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0302 0.0387
Entamoeba histolytica hypothetical protein 0.0019 0.0302 0.0383
Schistosoma mansoni growth factor receptor-bound protein 0.0009 0.0027 0.0035
Loa Loa (eye worm) hypothetical protein 0.0011 0.009 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0011 0.008 0.0098
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0011 0.009 0.0115
Echinococcus granulosus neuroglian 0.0011 0.008 0.0077
Entamoeba histolytica translation initiation factor 4e, putative 0.0034 0.0734 0.0937
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Leishmania major eukaryotic translation initiation factor-like 0.0288 0.7807 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.144 0.0998
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0302 0.0299
Loa Loa (eye worm) small GTPase 0.0012 0.0112 0.014
Schistosoma mansoni adapter molecule crk 0.0009 0.0027 0.0035
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0011 0.008 0.0102
Brugia malayi small GTPase 0.0012 0.0112 0.014
Leishmania major eukaryotic translation initiation factor eIF-4E, putative 0.0288 0.7807 1
Giardia lamblia Hypothetical protein 0.0034 0.0734 1
Schistosoma mansoni nephrin 0.0011 0.008 0.0102
Entamoeba histolytica hypothetical protein 0.0019 0.0302 0.0383
Schistosoma mansoni tyrosine kinase 0.0013 0.0127 0.0162
Plasmodium falciparum eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.5
Trypanosoma cruzi Eukaryotic translation initiation factor 4E type 5, putative 0.0034 0.0734 0.0808
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.144 0.1844
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0009 0.0027 0.0031
Giardia lamblia Hypothetical protein 0.0034 0.0734 1
Loa Loa (eye worm) GTP-binding protein 0.0137 0.3595 0.4602
Echinococcus granulosus growth factor receptor bound protein 2 0.0009 0.0027 0.0024
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0302 0.0299
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0302 0.0387
Brugia malayi Fibronectin type III domain containing protein 0.0016 0.0211 0.0266
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0013 0.0127 0.0124
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0013 0.0127 0.0124
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.1098 0.1403
Brugia malayi A-kinase anchor protein 10, precursor 0.0019 0.0302 0.0383
Echinococcus granulosus roundabout 2 0.0011 0.008 0.0077
Echinococcus granulosus eukaryotic translation initiation factor 4E type 0.0034 0.0734 0.0731
Schistosoma mansoni gtpase_rho 0.0012 0.0112 0.0144
Schistosoma mansoni z-protein (S1r protein) 0.0019 0.0302 0.0387
Schistosoma mansoni eukaryotic translation initiation factor 4e 0.0288 0.7807 1
Entamoeba histolytica hypothetical protein 0.0034 0.0734 0.0937
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Schistosoma mansoni tyrosine kinase 0.0008 0.0003 0.0004
Trypanosoma cruzi eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative 0.0034 0.0734 0.0808
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0034 0.0734 0.0808
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-1 0.0288 0.7807 1
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0734 0.0808
Echinococcus granulosus tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Echinococcus granulosus contactin 0.0011 0.008 0.0077
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0019 0.0302 0.0387
Brugia malayi translation initiation factor 4E 0.0288 0.7807 1
Entamoeba histolytica hypothetical protein 0.0019 0.0302 0.0383
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0185 0.4939 0.6325
Echinococcus multilocularis neuroglian 0.0011 0.008 0.0077
Entamoeba histolytica hypothetical protein 0.0034 0.0734 0.0937
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Onchocerca volvulus 0.0047 0.1098 0.2379
Brugia malayi Variant SH3 domain containing protein 0.0009 0.0027 0.0031
Schistosoma mansoni nephrin 0.0018 0.0291 0.0373
Giardia lamblia hypothetical protein 0.0034 0.0734 1
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0019 0.0302 0.0246
Plasmodium vivax hypothetical protein, conserved 0.0034 0.0734 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Echinococcus multilocularis eukaryotic translation initiation factor 4E 0.0288 0.7807 0.7806
Loa Loa (eye worm) SRC-1 0.0013 0.0127 0.0158
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0011 0.008 0.0077
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0302 0.0299
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0019 0.0302 0.0299
Loa Loa (eye worm) hypothetical protein 0.0011 0.008 0.0098
Brugia malayi hypothetical protein 0.0016 0.0211 0.0266
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0011 0.008 0.0098
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0013 0.0127 0.0124
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0302 0.0299
Onchocerca volvulus Putative eukaryotic translation initiation factor 4e 0.0034 0.0734 0.1589
Loa Loa (eye worm) hypothetical protein 0.0011 0.009 0.0111
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Loa Loa (eye worm) translation initiation factor 4E 0.0288 0.7807 1
Echinococcus multilocularis roundabout 2 0.0011 0.008 0.0077
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0011 0.009 0.0087
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0302 0.0387
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0019 0.0302 0.0383
Entamoeba histolytica eukaryotic initiation factor 4E, putative 0.0034 0.0734 0.0937
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0302 0.0387
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0302 0.0383
Loa Loa (eye worm) rac GTPase 0.0012 0.0112 0.014
Echinococcus multilocularis Immunoglobulin 0.0011 0.009 0.0087
Schistosoma mansoni cell adhesion molecule 0.0011 0.008 0.0102
Brugia malayi hypothetical protein 0.0232 0.6253 0.8009
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0034 0.0734 0.0808
Brugia malayi Immunoglobulin I-set domain containing protein 0.0011 0.008 0.0098
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0019 0.0302 0.0299
Brugia malayi Immunoglobulin I-set domain containing protein 0.0185 0.4939 0.6325
Onchocerca volvulus Tyrosine kinase homolog 0.0173 0.4604 1
Brugia malayi PXA domain containing protein 0.0019 0.0302 0.0383
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0734 0.0808
Schistosoma mansoni hypothetical protein 0.0047 0.1098 0.1406
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0013 0.0127 0.0124
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0011 0.008 0.0077
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0011 0.008 0.0098
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Brugia malayi Eukaryotic translation initiation factor 4E type 3, putative 0.0034 0.0734 0.0937
Echinococcus multilocularis ras gtpase 0.0137 0.3595 0.3593
Schistosoma mansoni tyrosine kinase 0.0008 0.0003 0.0004
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0034 0.0734 0.0808
Echinococcus granulosus ras gtpase 0.0137 0.3595 0.3593
Echinococcus granulosus Regulator of G protein signaling 20 0.0019 0.0302 0.0299
Echinococcus granulosus defective proboscis extension response 0.0011 0.009 0.0087
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0013 0.0127 0.0124
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0302 0.0246
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0302 0.0387
Echinococcus granulosus tyrosine protein kinase Lyn 0.0013 0.0127 0.0124
Echinococcus granulosus c src tyrosine kinase 0.0013 0.0127 0.0124
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0013 0.0127 0.0124
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0019 0.0302 0.0383
Echinococcus multilocularis NCK adaptor protein 0.0009 0.0027 0.0024
Entamoeba histolytica Rho family GTPase 0.0012 0.0112 0.014
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0288 0.7807 1
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0015 0.0192 0.0189
Echinococcus granulosus tyrosine protein kinase Src42A 0.0013 0.0127 0.0124
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0302 0.0299
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Echinococcus granulosus beta-adrenergic receptor kinase 0.0019 0.0302 0.0299
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.144 0.5
Plasmodium vivax translation initiation factor 4E, putative 0.0034 0.0734 0.5
Loa Loa (eye worm) hypothetical protein 0.0015 0.0192 0.0242
Toxoplasma gondii eukaryotic initiation factor-4E, putative 0.0288 0.7807 1
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.6253 0.6252
Brugia malayi Immunoglobulin I-set domain containing protein 0.0011 0.008 0.0098
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0937
Schistosoma mansoni cell polarity protein 0.0137 0.3595 0.4604
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0013 0.0127 0.0124
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0013 0.0127 0.0162
Plasmodium falciparum eukaryotic translation initiation factor 4E 0.0034 0.0734 0.5
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0013 0.0127 0.0124
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Schistosoma mansoni nck2/grb4 0.0009 0.0027 0.0035
Entamoeba histolytica eukaryotic initiation factor 4E, putative 0.0034 0.0734 0.0937
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0937
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.144 0.0998
Schistosoma mansoni tyrosine kinase 0.0013 0.0127 0.0162
Echinococcus multilocularis beta adrenergic receptor kinase 0.0019 0.0302 0.0299
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0034 0.0734 0.0808
Trypanosoma cruzi Eukaryotic translation initiation factor 4E type 5, putative 0.0034 0.0734 0.0808
Loa Loa (eye worm) hypothetical protein 0.0019 0.0302 0.0383
Echinococcus granulosus eukaryotic translation initiation factor 4E 0.0288 0.7807 0.7806
Schistosoma mansoni tyrosine kinase 0.0013 0.0127 0.0162
Loa Loa (eye worm) RGS-3 protein 0.0019 0.0302 0.0383

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.004 uM Inhibitory activity against p56 Lck tyrosine kinase at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.004 uM Inhibitory activity against p56 Lck tyrosine kinase at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.069 uM Inhibition of p56 Lck tyrosine kinase, in presence of 1 mM ATP ChEMBL. 11012022
IC50 (binding) = 0.5 uM Inhibitory activity against tie-2 at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.5 uM Inhibitory activity against tie-2 at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 0.91 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) = 0.91 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain) ChEMBL. 11012022
IC50 (binding) = 3.2 uM Inhibitory activity against vascular endothelial growth factor receptor 2 (VEGFR2) at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 3.2 uM Inhibitory activity against vascular endothelial growth factor receptor 2 (VEGFR2) at a concentration of 5 microM ATP. ChEMBL. 11012022
IC50 (binding) = 15.2 uM Inhibition of p56 Lck tyrosine kinase (catalytic domain), in presence of 1 mM ATP ChEMBL. 11012022
IC50 (binding) > 50 uM Inhibition of src, in presence of 1 mM 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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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