Detailed information for compound 1146834

Basic information

Technical information
  • TDR Targets ID: 1146834
  • Name: (2E,6S,7R,8E,11S)-6,7,15,17-tetrahydroxy-11-m ethyl-12-oxabicyclo[12.4.0]octadeca-1(14),2,8 ,15,17-pentaen-13-one
  • MW: 334.364 | Formula: C18H22O6
  • H donors: 4 H acceptors: 5 LogP: 2.88 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: C[C@H]1C/C=C/[C@@H](O)[C@@H](O)CC/C=C/c2c(C(=O)O1)c(O)cc(c2)O
  • InChi: 1S/C18H22O6/c1-11-5-4-8-15(21)14(20)7-3-2-6-12-9-13(19)10-16(22)17(12)18(23)24-11/h2,4,6,8-11,14-15,19-22H,3,5,7H2,1H3/b6-2+,8-4+/t11-,14-,15+/m0/s1
  • InChiKey: NHAQNKDEUQPSIX-DXOCLGOBSA-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 cyclin-dependent kinase 5 Starlite/ChEMBL References
Homo sapiens fms-related tyrosine kinase 3 Starlite/ChEMBL References
Homo sapiens polo-like kinase 4 Starlite/ChEMBL References
Homo sapiens protein kinase C, epsilon Starlite/ChEMBL References
Homo sapiens AXL receptor tyrosine kinase Starlite/ChEMBL References
Homo sapiens cyclin-dependent kinase 3 Starlite/ChEMBL References
Homo sapiens MAP kinase interacting serine/threonine kinase 2 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni kinase Get druggable targets OG5_134726 All targets in OG5_134726
Schistosoma japonicum Serine/threonine-protein kinase PLK4, putative Get druggable targets OG5_134726 All targets in OG5_134726
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus protein kinase c epsilon type Get druggable targets OG5_129314 All targets in OG5_129314
Schistosoma japonicum ko:K02090 cyclin-dependent kinase 5, putative Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium vivax protein kinase Crk2 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania braziliensis cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma cruzi cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania major cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania mexicana cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania mexicana cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Neospora caninum CMGC kinase, CDK family TgPK2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum Protein kinase C epsilon type, putative Get druggable targets OG5_129314 All targets in OG5_129314
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium berghei cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi Protein kinase domain containing protein Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei cdc2-related kinase 3 Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica PH domain containing protein kinase, putative Get druggable targets OG5_129314 All targets in OG5_129314
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei gambiense cell division protein kinase 2 homolog 1,cdc2- like protein kinase, putative Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) AGC/PKC/ETA protein kinase Get druggable targets OG5_129314 All targets in OG5_129314
Schistosoma japonicum Serine/threonine-protein kinase PLK4, putative Get druggable targets OG5_134726 All targets in OG5_134726
Babesia bovis cell division control protein 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum ko:K02087 cyclin-dependent kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis serine:threonine protein kinase N2 Get druggable targets OG5_129314 All targets in OG5_129314
Trypanosoma cruzi cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania braziliensis cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium yoelii cdc2-related kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma congolense cdc2-related kinase 1, putative Get druggable targets OG5_126712 All targets in OG5_126712
Candida albicans Protein kinase that can substitute for S. cerevisiae CDC28 (YBR160W) main cell cycle cyclin-dependent kinase Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis Serine:threonine protein kinase PLK4 Get druggable targets OG5_134726 All targets in OG5_134726
Trypanosoma brucei cdc2-related kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma japonicum ko:K06068 novel protein kinase C, putative Get druggable targets OG5_129314 All targets in OG5_129314
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Trypanosoma brucei gambiense cell division related protein kinase 2, putative,CDC2-related protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis cyclin dependent kinase 1 Get druggable targets OG5_126712 All targets in OG5_126712
Entamoeba histolytica cell division protein kinase 2, putative Get druggable targets OG5_126712 All targets in OG5_126712
Plasmodium knowlesi Cell division control protein 2 homolog Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus serine:threonine protein kinase N2 Get druggable targets OG5_129314 All targets in OG5_129314
Cryptosporidium parvum Cdc2-like CDK2/CDC28 like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus multilocularis protein kinase c epsilon type Get druggable targets OG5_129314 All targets in OG5_129314
Schistosoma japonicum IPR008957,Fibronectin, type III-like fold,domain-containing Get druggable targets OG5_132328 All targets in OG5_132328
Trypanosoma congolense cdc2-related kinase 3, putative Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi protein kinase C II. Get druggable targets OG5_129314 All targets in OG5_129314
Loa Loa (eye worm) camk/mapkapk/mnk protein kinase Get druggable targets OG5_131958 All targets in OG5_131958
Plasmodium falciparum protein kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania major cell division related protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_129314 All targets in OG5_129314
Trichomonas vaginalis CMGC family protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Brugia malayi Protein kinase domain containing protein Get druggable targets OG5_131958 All targets in OG5_131958
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania donovani cell division protein kinase 2 Get druggable targets OG5_126712 All targets in OG5_126712
Giardia lamblia Kinase, CMGC CDK Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus Serine:threonine protein kinase PLK4 Get druggable targets OG5_134726 All targets in OG5_134726
Echinococcus multilocularis cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
Cryptosporidium hominis cdc2-like protein kinase Get druggable targets OG5_126712 All targets in OG5_126712
Theileria parva cell division control protein 2 related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126712 All targets in OG5_126712
Leishmania infantum cell division protein kinase 2,cdc2-related kinase Get druggable targets OG5_126712 All targets in OG5_126712
Echinococcus granulosus cyclin dependent kinase 5 Get druggable targets OG5_126712 All targets in OG5_126712
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Trypanosoma brucei mitogen-activated protein kinase 5 cyclin-dependent kinase 3 305 aa 303 aa 32.0 %
Trypanosoma brucei mitogen-activated protein kinase 5 cyclin-dependent kinase 5 260 aa 307 aa 28.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.00655264 0.0846057 0.311855
Echinococcus granulosus cyclins 0.00382225 0.0401118 0.147851
Plasmodium falciparum protein kinase 5 0.0105357 0.149512 1
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0105357 0.149512 1
Echinococcus granulosus tensin 0.00157342 0.00346544 0.0127736
Echinococcus granulosus Immunoglobulin 0.00187266 0.0083418 0.0307477
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.00187266 0.0083418 0.0307477
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.00230334 0.0153602 0.0566173
Echinococcus granulosus cyclins 0.00382225 0.0401118 0.147851
Brugia malayi SH2 domain containing protein 0.00235547 0.0162096 0.0127885
Schistosoma mansoni tensin 0.00157342 0.00346544 0.00925626
Echinococcus granulosus N chimaerin 0.00230334 0.0153602 0.0566173
Entamoeba histolytica protein kinase, putative 0.00179982 0.00715487 0.0252619
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Schistosoma mansoni tensin-related 0.00157342 0.00346544 0.00925626
Echinococcus granulosus SH2 domain containing protein 7 0.00157342 0.00346544 0.0127736
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.00230334 0.0153602 0.0410273
Echinococcus granulosus tensin C1 domain containing phosphatase 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Echinococcus granulosus suppressor of cytokine signaling 6 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis tyrosine protein kinase shark 0.00235547 0.0162096 0.0597484
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.00230334 0.0153602 0.0410273
Echinococcus granulosus tyrosine protein kinase Src64B 0.00235547 0.0162096 0.0597484
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Schistosoma mansoni cyclins 0.00382225 0.0401118 0.107139
Echinococcus granulosus tyrosine protein kinase Srms 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis protein kinase c epsilon type 0.0103675 0.146771 0.540997
Schistosoma mansoni cell adhesion molecule 0.00245136 0.0177722 0.0474699
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Entamoeba histolytica cell division protein kinase 2, putative 0.0105357 0.149512 1
Echinococcus multilocularis SH2 motif 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis cyclin dependent kinase 0.0105357 0.149512 0.5511
Echinococcus granulosus neuroglian 0.00187266 0.0083418 0.0307477
Leishmania major CYC2-like cyclin, putative,cyclin 6, putative 0.0086492 0.118771 0.526371
Trypanosoma cruzi cdc2-related kinase 3 0.0105357 0.149512 1
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Schistosoma mansoni SH2A 0.00157342 0.00346544 0.00925626
Loa Loa (eye worm) SRC-1 0.00235547 0.0162096 0.0127885
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0105357 0.149512 0.5511
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.00235547 0.0162096 0.0597484
Schistosoma mansoni signal transduction protein lnk-related 0.00157342 0.00346544 0.00925626
Trypanosoma cruzi cyclin, putative 0.0086492 0.118771 0.526371
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.00235547 0.0162096 0.0597484
Schistosoma mansoni suppressor of cytokine signaling 0.00157342 0.00346544 0.00925626
Schistosoma mansoni tensin 0.00157342 0.00346544 0.00925626
Loa Loa (eye worm) hypothetical protein 0.00482695 0.0564842 0.0532031
Echinococcus granulosus tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Giardia lamblia Kinase, CMGC CDK 0.0105357 0.149512 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Brugia malayi Cyclin, N-terminal domain containing protein 0.0086492 0.118771 0.115706
Echinococcus granulosus cyclins 0.00382225 0.0401118 0.147851
Echinococcus granulosus roundabout 2 0.00245136 0.0177722 0.0655081
Trichomonas vaginalis cyclins, putative 0.00580367 0.0724006 0.295143
Echinococcus granulosus SH2 domain containing adapter protein F 0.00157342 0.00346544 0.0127736
Entamoeba histolytica cyclin, putative 0.0086492 0.118771 0.789508
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Loa Loa (eye worm) hypothetical protein 0.00245136 0.0177722 0.0143565
Plasmodium vivax protein kinase Crk2 0.0105357 0.149512 0.5
Echinococcus multilocularis cyclin dependent kinase 1 0.0105357 0.149512 0.5511
Entamoeba histolytica cyclin family protein 0.00382225 0.0401118 0.250922
Schistosoma mansoni cyclin B 0.0086492 0.118771 0.317239
Trichomonas vaginalis cyclin B, putative 0.0086492 0.118771 0.718998
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Trichomonas vaginalis cyclin B, putative 0.0086492 0.118771 0.718998
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Echinococcus granulosus tyrosine protein kinase Src42A 0.00235547 0.0162096 0.0597484
Entamoeba histolytica cell division protein kinase 2, putative 0.0105357 0.149512 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.00258188 0.0198991 0.0733476
Brugia malayi Protein kinase domain containing protein 0.00235547 0.0162096 0.0127885
Trichomonas vaginalis cyclin B, putative 0.0086492 0.118771 0.718998
Echinococcus multilocularis suppressor of cytokine signaling 6 0.00157342 0.00346544 0.0127736
Schistosoma mansoni GTPase activating protein 0.00157342 0.00346544 0.00925626
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Trypanosoma brucei cdc2-related kinase 3 0.0105357 0.149512 1
Echinococcus granulosus cyclin B 0.0086492 0.118771 0.437787
Brugia malayi hypothetical protein 0.00245136 0.0177722 0.0143565
Echinococcus granulosus raf serine:threonine protein kinase 0.00151198 0.0024643 0.00908336
Loa Loa (eye worm) variant SH3 domain-containing protein 0.00164113 0.00456884 0.00110723
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Brugia malayi Cyclin, N-terminal domain containing protein 0.00382225 0.0401118 0.0367738
Echinococcus granulosus serine:threonine protein kinase N2 0.00855974 0.117313 0.432413
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Echinococcus multilocularis cyclin B3 1 0.00382225 0.0401118 0.147851
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Brugia malayi protein-tyrosine kinase 0.00235547 0.0162096 0.0127885
Brugia malayi Fibronectin type III domain containing protein 0.00245136 0.0177722 0.0143565
Brugia malayi cell division control protein 2 homolog 0.0105357 0.149512 0.146555
Echinococcus granulosus cyclin B3 1 0.00382225 0.0401118 0.147851
Schistosoma mansoni growth factor receptor-bound protein 0.00157342 0.00346544 0.00925626
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0105357 0.149512 0.146555
Brugia malayi Immunoglobulin I-set domain containing protein 0.00265471 0.021086 0.0176818
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis tyrosine protein kinase Src42A 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis signal transduction protein lnk realted 0.00157342 0.00346544 0.0127736
Echinococcus granulosus NCK adaptor protein 0.00157342 0.00346544 0.0127736
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Echinococcus granulosus tyrosine protein kinase shark 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis cyclins, putative 0.0086492 0.118771 0.718998
Loa Loa (eye worm) hypothetical protein 0.00245136 0.0177722 0.0143565
Echinococcus multilocularis neuroglian 0.00187266 0.0083418 0.0307477
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Echinococcus multilocularis basement membrane specific heparan sulfate 0.00187266 0.0083418 0.0307477
Echinococcus granulosus cyclins 0.00382225 0.0401118 0.147851
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.00187266 0.0083418 0.0222811
Schistosoma mansoni serine/threonine protein kinase 0.00151198 0.0024643 0.00658219
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Echinococcus multilocularis raf serine:threonine protein kinase 0.00151198 0.0024643 0.00908336
Echinococcus granulosus Protein kinase C brain isozyme 0.00203414 0.0109733 0.0404474
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Brugia malayi SH2 domain containing protein 0.00235547 0.0162096 0.0127885
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0105357 0.149512 1
Trypanosoma brucei cdc2-related kinase 1 0.0105357 0.149512 1
Echinococcus multilocularis SH2 domain containing adapter protein F 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) cyclin domain-containing protein 0.00382225 0.0401118 0.0367738
Giardia lamblia Kinase, PLK 0.00655264 0.0846057 0.406706
Trypanosoma cruzi CYC2-like cyclin, putative 0.0086492 0.118771 0.526371
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Echinococcus granulosus cyclin dependent kinase 0.0105357 0.149512 0.5511
Echinococcus multilocularis tensin 0.00157342 0.00346544 0.0127736
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0105357 0.149512 1
Onchocerca volvulus Serine\/threonine kinase homolog 0.00655264 0.0846057 0.7037
Echinococcus multilocularis SHC transforming protein 3 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Echinococcus multilocularis SH2 motif 0.00157342 0.00346544 0.0127736
Brugia malayi Protein kinase domain containing protein 0.00235547 0.0162096 0.0127885
Echinococcus granulosus protein kinase c iota type 0.00196643 0.0098699 0.0363803
Echinococcus granulosus SH2 motif 0.00157342 0.00346544 0.0127736
Echinococcus granulosus tyrosine protein kinase Blk 0.00235547 0.0162096 0.0597484
Loa Loa (eye worm) camk/mapkapk/mnk protein kinase 0.0627264 1 1
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Trypanosoma cruzi cdc2-related kinase 1 0.0105357 0.149512 1
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Echinococcus granulosus protein kinase c epsilon type 0.0103675 0.146771 0.540997
Schistosoma mansoni serine/threonine protein kinase 0.00203414 0.0109733 0.0293099
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Echinococcus multilocularis tyrosine protein kinase Src64B 0.00235547 0.0162096 0.0597484
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0105357 0.149512 0.146555
Loa Loa (eye worm) RhoGAP domain-containing protein 0.00230334 0.0153602 0.0119361
Schistosoma mansoni vesicular amine transporter 0.00187266 0.0083418 0.0222811
Echinococcus multilocularis tyrosine protein kinase ABL1 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Brugia malayi Immunoglobulin I-set domain containing protein 0.00245136 0.0177722 0.0143565
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.00655264 0.0846057 0.0814224
Brugia malayi Cyclin, N-terminal domain containing protein 0.0086492 0.118771 0.115706
Brugia malayi serine/threonine-protein kinase plk-2 0.00655264 0.0846057 0.0814224
Giardia lamblia G2/mitotic-specific cyclin B 0.0086492 0.118771 0.718998
Schistosoma mansoni serine/threonine protein kinase 0.0105357 0.149512 0.39935
Brugia malayi Protein kinase domain containing protein 0.0105357 0.149512 0.146555
Echinococcus granulosus tyrosine kinase 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis tyrosine protein kinase Fps85D 0.00235547 0.0162096 0.0597484
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Trypanosoma cruzi cyclin 6, putative 0.0086492 0.118771 0.526371
Echinococcus multilocularis G2:mitotic specific cyclin B3 0.00382225 0.0401118 0.147851
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis cyclins, putative 0.0086492 0.118771 0.718998
Echinococcus multilocularis tyrosine kinase 0.00235547 0.0162096 0.0597484
Schistosoma mansoni kinase 0.0243354 0.374389 1
Giardia lamblia Kinase, CMGC CDK 0.0105357 0.149512 1
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Echinococcus multilocularis suppressor of cytokine signaling 7 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) TK/ABL protein kinase 0.00235547 0.0162096 0.0127885
Schistosoma mansoni tyrosine kinase 0.00235547 0.0162096 0.0432962
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.00157342 0.00346544 0.0127736
Echinococcus granulosus G2:mitotic specific cyclin B3 0.00382225 0.0401118 0.147851
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Schistosoma mansoni cyclin B3 0.00382225 0.0401118 0.107139
Echinococcus multilocularis protein kinase c iota type 0.00196643 0.0098699 0.0363803
Echinococcus granulosus tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Loa Loa (eye worm) hypothetical protein 0.0086492 0.118771 0.115706
Trypanosoma cruzi cdc2-related kinase 3 0.0105357 0.149512 1
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Echinococcus multilocularis N chimaerin 0.00230334 0.0153602 0.0566173
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Echinococcus multilocularis cyclin dependent kinase 1 0.0105357 0.149512 0.5511
Brugia malayi Tyrosine-protein kinase abl-1 0.00235547 0.0162096 0.0127885
Schistosoma mansoni hypothetical protein 0.00157342 0.00346544 0.00925626
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0103675 0.146771 0.143804
Echinococcus multilocularis Immunoglobulin 0.00187266 0.0083418 0.0307477
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.00157342 0.00346544 0.0127736
Trichomonas vaginalis cyclins, putative 0.0086492 0.118771 0.718998
Echinococcus multilocularis 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0105357 0.149512 0.146555
Schistosoma mansoni shc transforming protein 0.00157342 0.00346544 0.00925626
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Echinococcus granulosus SH2 motif 0.00157342 0.00346544 0.0127736
Entamoeba histolytica serine/threonine protein kinase, putative 0.00655264 0.0846057 0.555576
Trypanosoma cruzi cdc2-related kinase 1 0.0105357 0.149512 1
Echinococcus granulosus cyclin dependent kinase 1 0.0105357 0.149512 0.5511
Entamoeba histolytica PH domain containing protein kinase, putative 0.00855974 0.117313 0.779526
Brugia malayi Variant SH3 domain containing protein 0.00164113 0.00456884 0.00110723
Entamoeba histolytica cyclin, putative 0.00382225 0.0401118 0.250922
Echinococcus granulosus hypothetical protein 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis NCK adaptor protein 0.00157342 0.00346544 0.0127736
Schistosoma mansoni serine/threonine protein kinase 0.00203414 0.0109733 0.0293099
Trichomonas vaginalis cyclins, putative 0.0086492 0.118771 0.718998
Echinococcus granulosus tyrosine protein kinase Fps85D 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Echinococcus multilocularis cyclin B 0.0086492 0.118771 0.437787
Brugia malayi RhoGAP domain containing protein 0.00230334 0.0153602 0.0119361
Echinococcus multilocularis growth factor receptor bound protein 2 0.00157342 0.00346544 0.0127736
Schistosoma mansoni tensin 0.00157342 0.00346544 0.00925626
Echinococcus granulosus twitchin 0.00209906 0.0120312 0.0443469
Echinococcus granulosus phosphatidylinositol 3 kinase regulatory subunit 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Trypanosoma brucei mitotic cyclin 6 0.0086492 0.118771 0.526371
Echinococcus granulosus Serine:threonine protein kinase PLK4 0.0180091 0.271298 1
Echinococcus multilocularis phosphatidylinositol 3 kinase regulatory subunit 0.00157342 0.00346544 0.0127736
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.00235547 0.0162096 0.0597484
Entamoeba histolytica SH2-protein kinase domain containing protein 0.00235547 0.0162096 0.0872609
Brugia malayi hypothetical protein 0.00235547 0.0162096 0.0127885
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.00235547 0.0162096 0.0597484
Echinococcus granulosus tyrosine kinase 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis serine:threonine protein kinase N2 0.00956984 0.133773 0.493086
Brugia malayi Variant SH3 domain containing protein 0.00230334 0.0153602 0.0119361
Echinococcus multilocularis tyrosine protein kinase Abl 0.00235547 0.0162096 0.0597484
Echinococcus granulosus tyrosine protein kinase ABL1 0.00235547 0.0162096 0.0597484
Schistosoma mansoni hypothetical protein 0.00157342 0.00346544 0.00925626
Loa Loa (eye worm) hypothetical protein 0.0103093 0.145823 0.142853
Echinococcus multilocularis tyrosine protein kinase Fgr 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis cyclin dependent kinase 5 0.0105357 0.149512 0.5511
Echinococcus multilocularis SH2 motif 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Echinococcus granulosus signal transduction protein lnk realted 0.00157342 0.00346544 0.0127736
Trichomonas vaginalis CMGC family protein kinase 0.0105357 0.149512 1
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.00230334 0.0153602 0.0566173
Entamoeba histolytica cyclin family protein 0.00382225 0.0401118 0.250922
Echinococcus multilocularis Immunoglobulin 0.00187266 0.0083418 0.0307477
Trichomonas vaginalis CMGC family protein kinase 0.0105357 0.149512 1
Schistosoma mansoni adapter molecule crk 0.00157342 0.00346544 0.00925626
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.00157342 0.00346544 0.00925626
Echinococcus granulosus tyrosine protein kinase Src42A 0.00157342 0.00346544 0.0127736
Loa Loa (eye worm) hypothetical protein 0.00235547 0.0162096 0.0127885
Echinococcus multilocularis suppressor of cytokine signaling 7 0.00157342 0.00346544 0.0127736
Echinococcus granulosus cyclin dependent kinase 5 0.0105357 0.149512 0.5511
Brugia malayi Protein kinase domain containing protein 0.00235547 0.0162096 0.0127885
Echinococcus multilocularis tyrosine protein kinase Src42A 0.00235547 0.0162096 0.0597484
Echinococcus granulosus c src tyrosine kinase 0.00235547 0.0162096 0.0597484
Entamoeba histolytica SH2-protein kinase domain containing protein 0.00179982 0.00715487 0.0252619
Schistosoma mansoni tyrosine-protein kinase zap-70 0.00157342 0.00346544 0.00925626
Schistosoma mansoni growth factor receptor-bound protein 0.00157342 0.00346544 0.00925626
Echinococcus granulosus SHC transforming protein 3 0.00157342 0.00346544 0.0127736
Brugia malayi Protein kinase domain containing protein 0.00235547 0.0162096 0.0127885
Echinococcus granulosus defective proboscis extension response 0.00187266 0.0083418 0.0307477
Echinococcus granulosus cyclin b3 0.00382225 0.0401118 0.147851
Trichomonas vaginalis CAMK family protein kinase 0.00655264 0.0846057 0.406706
Echinococcus multilocularis c src tyrosine kinase 0.00235547 0.0162096 0.0597484
Schistosoma mansoni nephrin 0.00245136 0.0177722 0.0474699
Echinococcus multilocularis tensin 0.00157342 0.00346544 0.0127736
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.00157342 0.00346544 0.0127736
Echinococcus granulosus tyrosine protein kinase Btk29A 0.00235547 0.0162096 0.0597484
Trichomonas vaginalis cyclin B, putative 0.0086492 0.118771 0.718998
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Echinococcus granulosus cyclins 0.00382225 0.0401118 0.147851
Echinococcus multilocularis Serine:threonine protein kinase PLK4 0.0180091 0.271298 1
Brugia malayi protein kinase C II. 0.0103675 0.146771 0.143804
Echinococcus multilocularis Protein kinase C, brain isozyme 0.00203414 0.0109733 0.0404474
Echinococcus granulosus growth factor receptor bound protein 2 0.00157342 0.00346544 0.0127736
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.00235547 0.0162096 0.0432962
Schistosoma mansoni nck2/grb4 0.00157342 0.00346544 0.00925626
Brugia malayi Protein kinase domain containing protein 0.0627264 1 1
Trichomonas vaginalis cyclin A, putative 0.0086492 0.118771 0.718998
Schistosoma mansoni serine/threonine protein kinase 0.0105357 0.149512 0.39935
Echinococcus granulosus serine:threonine protein kinase PLK1 0.00655264 0.0846057 0.311855
Echinococcus multilocularis tyrosine protein kinase Srms 0.00235547 0.0162096 0.0597484
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.00235547 0.0162096 0.0597484
Brugia malayi Protein kinase domain containing protein 0.00235547 0.0162096 0.0127885
Loa Loa (eye worm) TK/FER protein kinase 0.00235547 0.0162096 0.0127885
Loa Loa (eye worm) TK/KIN16 protein kinase 0.00265471 0.021086 0.0176818
Brugia malayi SRC-1 0.00235547 0.0162096 0.0127885
Schistosoma mansoni atypical protein kinase C 0.00196643 0.0098699 0.0263627
Loa Loa (eye worm) hypothetical protein 0.00245136 0.0177722 0.0143565
Schistosoma mansoni suppressor of cytokine signaling 0.00157342 0.00346544 0.00925626
Echinococcus granulosus suppressor of cytokine signaling 7 0.00157342 0.00346544 0.0127736
Onchocerca volvulus 0.0086492 0.118771 1
Onchocerca volvulus 0.00235547 0.0162096 0.110526
Loa Loa (eye worm) hypothetical protein 0.0086492 0.118771 0.115706
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Echinococcus multilocularis cyclin b3 0.00382225 0.0401118 0.147851
Echinococcus multilocularis SH2 domain containing protein 7 0.00157342 0.00346544 0.0127736
Trypanosoma cruzi cyclin, putative 0.0086492 0.118771 0.526371
Echinococcus multilocularis roundabout 2 0.00245136 0.0177722 0.0655081
Loa Loa (eye worm) TK protein kinase 0.00235547 0.0162096 0.0127885
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.00157342 0.00346544 0.00925626
Schistosoma mansoni serine/threonine protein kinase 0.0103675 0.146771 0.392029
Echinococcus multilocularis cyclins 0.00382225 0.0401118 0.147851
Schistosoma mansoni serine/threonine protein kinase 0.00655264 0.0846057 0.225983
Echinococcus granulosus expressed conserved protein 0.00157342 0.00346544 0.0127736
Schistosoma mansoni Neurotrimin precursor (hNT) 0.00187266 0.0083418 0.0222811
Echinococcus multilocularis tyrosine protein kinase Blk 0.00235547 0.0162096 0.0597484
Echinococcus granulosus tyrosine protein kinase Fyn 0.00235547 0.0162096 0.0597484
Schistosoma mansoni tensin-related 0.00157342 0.00346544 0.00925626
Trichomonas vaginalis CMGC family protein kinase 0.0105357 0.149512 1
Leishmania major cyclin 0.0086492 0.118771 0.526371
Loa Loa (eye worm) hypothetical protein 0.00187266 0.0083418 0.00489332
Schistosoma mansoni vav2 0.00230334 0.0153602 0.0410273

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) = 0.15 % Inhibition of MNK2 assessed as enzyme activity at 10 uM relative to control ChEMBL. 24900361
Activity (binding) = 4.7 % Inhibition of AXL assessed as enzyme activity at 10 uM relative to control ChEMBL. 24900361
Activity (binding) = 7.1 % Inhibition of FLT3 assessed as enzyme activity at 10 uM relative to control ChEMBL. 24900361
Activity (binding) = 7.2 % Inhibition of PRKCE assessed as enzyme activity at 10 uM relative to control ChEMBL. 24900361
Activity (binding) = 9.6 % Inhibition of PLK4 assessed as enzyme activity at 10 uM relative to control ChEMBL. 24900361
IC50 (functional) = 6.6 ug ml-1 Antimalarial activity against Plasmodium falciparum K1 ChEMBL. 19299148
IC50 (binding) = 0.45 uM Inhibition of MNK2 using 5-FAM-TATKSGSTTKNRFVV-NH2 as substrate preincubated for 1 hr prior substrate addition measured after 2 hrs by IMAP assay ChEMBL. 24900361
IC50 (functional) = 3.1 uM Antiplasmodial activity against chloroquine-susceptible Plasmodium falciparum 3D7 after 72 hrs by malaria SYBR Green I-based fluorescence assay ChEMBL. 20429578
IC50 (binding) = 6 uM Inhibition of CDK5 ChEMBL. 24900361
IC50 (binding) = 6 uM Inhibition of CDK1 ChEMBL. 24900361
IC50 (functional) = 10.5 uM Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum Dd2 after 72 hrs by malaria SYBR Green I-based fluorescence assay ChEMBL. 20429578
IC50 (binding) = 21 uM Inhibition of CDK2/cyclin A using 5-FAM-GGGPATPKKAKKL-COOH as substrate after 1 hr by IMAP assay ChEMBL. 24900361
IC50 (binding) = 40 uM Inhibition of MNK1 ChEMBL. 24900361
Inhibition (binding) = 55 % Inhibition of CDK2/cyclin A using 5-FAM-GGGPATPKKAKKL-COOH as substrate at 10 uM after 1 hr by IMAP assay ChEMBL. 24900361
Kd (binding) = 0.16 uM Inhibition of MNK2 ChEMBL. 24900361
Kd (binding) = 0.26 uM Inhibition of PLK4 ChEMBL. 24900361
Kd (binding) = 0.3 uM Inhibition of FLT3 ChEMBL. 24900361
Kd (binding) = 1 uM Inhibition of AXL ChEMBL. 24900361
Kd (binding) = 12 uM Inhibition of PRKCE ChEMBL. 24900361

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 19299148

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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