Detailed information for compound 433588

Basic information

Technical information
  • TDR Targets ID: 433588
  • Name: 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[[1-[3 -(dimethylamino)propyl]triazol-4-yl]methylami no]quinoline-3-carbonitrile
  • MW: 557.848 | Formula: C24H23BrClFN8
  • H donors: 2 H acceptors: 4 LogP: 5.03 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: N#Cc1cnc2c(c1Nc1ccc(c(c1)Cl)F)cc(cc2Br)NCc1nnn(c1)CCCN(C)C
  • InChi: 1S/C24H23BrClFN8/c1-34(2)6-3-7-35-14-18(32-33-35)13-29-17-8-19-23(31-16-4-5-22(27)21(26)10-16)15(11-28)12-30-24(19)20(25)9-17/h4-5,8-10,12,14,29H,3,6-7,13H2,1-2H3,(H,30,31)
  • InChiKey: RUCXDAGQSXXFMK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 8-bromo-4-(3-chloro-4-fluoro-anilino)-6-[[1-[3-(dimethylamino)propyl]triazol-4-yl]methylamino]quinoline-3-carbonitrile
  • 8-bromo-4-(3-chloro-4-fluoroanilino)-6-[[1-[3-(dimethylamino)propyl]-4-triazolyl]methylamino]-3-quinolinecarbonitrile
  • 8-bromo-4-[(3-chloro-4-fluoro-phenyl)amino]-6-[[1-[3-(dimethylamino)propyl]-1,2,3-triazol-4-yl]methylamino]quinoline-3-carbonitrile

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens calcium/calmodulin-dependent protein kinase II gamma References
Homo sapiens calcium/calmodulin-dependent protein kinase II beta References
Homo sapiens calcium/calmodulin-dependent protein kinase II delta Starlite/ChEMBL References
Homo sapiens epidermal growth factor receptor Starlite/ChEMBL References
Homo sapiens mitogen-activated protein kinase kinase kinase 8 Starlite/ChEMBL References
Homo sapiens calcium/calmodulin-dependent protein kinase II alpha References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Theileria parva calcium-dependent protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Plasmodium falciparum calcium-dependent protein kinase 4 Get druggable targets OG5_126600 All targets in OG5_126600
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Candida albicans Serine-threonine protein kinase similar to S. cerevisiae CMK2 (YOL016C) calcium/calmodulin-dependent protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum IPR000494,EGF receptor, L domain,domain-containing Get druggable targets OG5_128597 All targets in OG5_128597
Brugia malayi Furin-like cysteine rich region family protein Get druggable targets OG5_128597 All targets in OG5_128597
Cryptosporidium hominis CDPK2 Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium yoelii calmodulin-domain protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium yoelii calcium-dept. protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Leishmania infantum protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Loa Loa (eye worm) TK/EGFR protein kinase Get druggable targets OG5_128597 All targets in OG5_128597
Neospora caninum Calcium-dependent protein kinase 2, related Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Leishmania donovani protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum hypothetical protein Get druggable targets OG5_128597 All targets in OG5_128597
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Cryptosporidium parvum calcium/calmodulin dependent protein kinase with a kinas domain and 4 calmodulin-like EF hands Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium knowlesi calcium-dependent protein kinase 4, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium berghei calcium-dependent protein kinase 5 Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum IPR006212,Furin-like repeat;IPR009030,Growth factor, receptor,domain-containing Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis Get druggable targets OG5_128597 All targets in OG5_128597
Toxoplasma gondii calcium-dependent protein kinase CDPK3 Get druggable targets OG5_126600 All targets in OG5_126600
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium knowlesi calcium-dependent protein kinase 3, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus melanoma receptor tyrosine protein kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Calcium/calmodulin-dependent protein kinase type II beta chain, putative Get druggable targets OG5_126600 All targets in OG5_126600
Entamoeba histolytica protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Leishmania braziliensis protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Neospora caninum hypothetical protein Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus granulosus calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Calcium/calmodulin-dependent protein kinase type II alpha chain, putative Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium yoelii Plasmodium falciparum CDPK2 protein Get druggable targets OG5_126600 All targets in OG5_126600
Candida albicans Serine-threonine protein kinase similar to S. cerevisiae CMK2 (YOL016C) calcium/calmodulin-dependent protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Cryptosporidium hominis calcium-dependent protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium knowlesi calcium-dependent protein kinase 1, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus granulosus calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum ko:K04515 calcium/calmodulin-dependent protein kinase (CaM kinase) II, putative Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium berghei calcium-dependent protein kinase 4 Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus granulosus calcium dependent protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Cryptosporidium hominis hypothetical protein Get druggable targets OG5_126600 All targets in OG5_126600
Cryptosporidium parvum calcium/calmodulin dependent protein kinase with a kinase domain and 4 calmodulin like EF hands Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium yoelii calcium-dependent protein kinase-3 Get druggable targets OG5_126600 All targets in OG5_126600
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Tyrosine-protein kinase transforming protein erbB, putative Get druggable targets OG5_128597 All targets in OG5_128597
Neospora caninum hypothetical protein Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Toxoplasma gondii calcium-dependent protein kinase CDPK2B Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium knowlesi calcium-dependent protein kinase 5, putative Get druggable targets OG5_126600 All targets in OG5_126600
Cryptosporidium hominis calmodulin-domain protein kinase 1 Get druggable targets OG5_126600 All targets in OG5_126600
Leishmania mexicana protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Neospora caninum Calmodulin-like domain protein kinase isoenzyme gamma, related Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Toxoplasma gondii calcium-dependent protein kinase CDPK2A Get druggable targets OG5_126600 All targets in OG5_126600
Neospora caninum hypothetical protein Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus granulosus epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum ko:K08794 calcium/calmodulin-dependent protein kinase I, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum ko:K05085 receptor tyrosine-protein kinase erbB-4, putative Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Receptor tyrosine-protein kinase erbB-2 precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Loa Loa (eye worm) CAMK/CAMK2 protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Trypanosoma brucei gambiense protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis epidermal growth factor receptor Get druggable targets OG5_128597 All targets in OG5_128597
Cryptosporidium parvum calmodulin-domain protein kinase 1, putative Get druggable targets OG5_126600 All targets in OG5_126600
Brugia malayi Cam kinase protein 1 Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium vivax calcium-dependent protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Theileria parva calmodulin-domain protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Calcium/calmodulin-dependent protein kinase type 1, putative Get druggable targets OG5_126600 All targets in OG5_126600
Echinococcus multilocularis calcium dependent protein kinase Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium vivax calcium-dependent protein kinase 3, putative Get druggable targets OG5_126600 All targets in OG5_126600
Cryptosporidium parvum calcium/calmodulin dependent protein kinase with a kinase domain and 4 calmodulin like EF hands Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium falciparum calcium-dependent protein kinase 1 Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Epidermal growth factor receptor precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Plasmodium falciparum calcium-dependent protein kinase 2 Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Plasmodium falciparum calcium-dependent protein kinase 5 Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium berghei calcium-dependent protein kinase 3 Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium vivax calcium-dependent protein kinase 4, putative Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum expressed protein Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma mansoni tyrosine kinase Get druggable targets OG5_128597 All targets in OG5_128597
Schistosoma japonicum Calcium/calmodulin-dependent protein kinase type II delta chain, putative Get druggable targets OG5_126600 All targets in OG5_126600
Babesia bovis calcium-dependent protein kinase 4 Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium berghei calcium-dependent protein kinase 1 Get druggable targets OG5_126600 All targets in OG5_126600
Leishmania major protein kinase, putative Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium vivax calcium-dependent protein kinase 1, putative Get druggable targets OG5_126600 All targets in OG5_126600
Plasmodium falciparum calcium-dependent protein kinase 3 Get druggable targets OG5_126600 All targets in OG5_126600
Babesia bovis protein kinase domain containing protein Get druggable targets OG5_126600 All targets in OG5_126600
Schistosoma japonicum Receptor tyrosine-protein kinase erbB-4 precursor, putative Get druggable targets OG5_128597 All targets in OG5_128597
Echinococcus granulosus calcium:calmodulin dependent protein kinase type Get druggable targets OG5_126600 All targets in OG5_126600
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
Toxoplasma gondii non-specific serine/threonine protein kinase 0.0131 0.0403 0.6015
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.0118 0.0358 0.5324
Loa Loa (eye worm) hypothetical protein 0.0075 0.0213 0.1218
Schistosoma mansoni cpg binding protein 0.0037 0.0088 0.0297
Loa Loa (eye worm) hypothetical protein 0.0118 0.0358 0.2045
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0075 0.0213 0.1068
Leishmania major hypothetical protein, unknown function 0.004 0.0098 0.0243
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Echinococcus multilocularis Zinc finger, PHD finger 0.004 0.0098 0.0098
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.0243
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0118 0.0358 0.0358
Echinococcus granulosus neuropeptide receptor A26 0.0269 0.0865 0.0865
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Loa Loa (eye worm) phosphatidylinositol 3 0.004 0.0098 0.0561
Plasmodium falciparum phosphatidylinositol 4-kinase 0.004 0.0098 0.4315
Entamoeba histolytica hypothetical protein 0.0023 0.0041 0.0467
Echinococcus multilocularis calcium dependent protein kinase 0.0072 0.0206 0.0206
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.004 0.0098 0.1339
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0118 0.0358 0.5324
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Onchocerca volvulus 0.004 0.0098 0.0791
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.005 0.0131 0.0517
Entamoeba histolytica hypothetical protein 0.004 0.0098 0.1339
Plasmodium falciparum calcium-dependent protein kinase 5 0.0075 0.0213 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0038 0.009 0.009
Schistosoma mansoni fkbp-rapamycin associated protein 0.0118 0.0358 0.1667
Echinococcus granulosus cpg binding protein 0.0037 0.0088 0.0088
Schistosoma mansoni protein kinase 0.0608 0.2 1
Brugia malayi Furin-like cysteine rich region family protein 0.018 0.0567 0.3123
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.004 0.0098 0.0243
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0209 0.0663 0.1812
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0062 0.0172 0.0981
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0209 0.0663 0.368
Loa Loa (eye worm) phosphatidylinositol kinase 0.004 0.0098 0.0561
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0209 0.0663 0.0663
Schistosoma mansoni tyrosine kinase 0.018 0.0567 0.2728
Schistosoma mansoni phosphatidylinositol 4-kinase 0.004 0.0098 0.0348
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.004 0.0098 0.0098
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.004 0.0098 0.4315
Schistosoma mansoni phosphatidylinositol 4-kinase 0.004 0.0098 0.0348
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0075 0.0213 0.3105
Onchocerca volvulus 0.004 0.0098 0.0791
Onchocerca volvulus Glucosylceramidase homolog 0.0099 0.0294 1
Loa Loa (eye worm) hypothetical protein 0.002 0.0029 0.0168
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.0098 0.1339
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0209 0.0663 0.1812
Echinococcus multilocularis cpg binding protein 0.0037 0.0088 0.0088
Echinococcus granulosus epidermal growth factor receptor 0.0097 0.0288 0.0288
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0209 0.0663 1
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.004 0.0098 0.1339
Mycobacterium ulcerans aldehyde dehydrogenase 0.0038 0.009 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0118 0.0358 0.0358
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0038 0.009 0.009
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0209 0.0663 0.1673
Schistosoma mansoni aldehyde dehydrogenase 0.0038 0.009 0.0307
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.004 0.0098 0.0098
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.004 0.0098 0.0348
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Trichomonas vaginalis conserved hypothetical protein 0.0131 0.0403 0.5399
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis CAMK family protein kinase 0.0075 0.0213 0.2038
Entamoeba histolytica hypothetical protein 0.0023 0.0041 0.0467
Giardia lamblia GTOR 0.0209 0.0663 1
Entamoeba histolytica protein kinase rad3, putative 0.0118 0.0358 0.5324
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0075 0.0213 0.1218
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0118 0.0358 0.077
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0014 0.0011 0.5
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0075 0.0213 0.0213
Schistosoma mansoni tyrosine kinase 0.0096 0.0284 0.1294
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0608 0.2 0.2
Schistosoma mansoni tyrosine kinase 0.0096 0.0284 0.1294
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0209 0.0663 1
Echinococcus multilocularis neuropeptide s receptor 0.0269 0.0865 0.0865
Entamoeba histolytica protein kinase, putative 0.0075 0.0213 0.3105
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.0223 0.2219
Loa Loa (eye worm) phosphatidylinositol 3 0.004 0.0098 0.0561
Echinococcus granulosus insulin receptor 0.0058 0.0156 0.0156
Schistosoma mansoni protein kinase 0.0608 0.2 1
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0075 0.0213 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0038 0.009 0.906
Plasmodium vivax hypothetical protein 0.004 0.0098 0.4315
Entamoeba histolytica hypothetical protein 0.0118 0.0358 0.5324
Schistosoma mansoni hypothetical protein 0.0023 0.0041 0.006
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0209 0.0663 0.1673
Loa Loa (eye worm) hypothetical protein 0.0062 0.0172 0.0981
Schistosoma mansoni tyrosine kinase 0.0058 0.0156 0.0644
Loa Loa (eye worm) TK/EGFR protein kinase 0.018 0.0567 0.3239
Echinococcus multilocularis 0.0056 0.015 0.015
Mycobacterium tuberculosis Conserved hypothetical protein 0.004 0.0098 1
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0078 0.0223 0.0371
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.004 0.0098 0.4315
Schistosoma mansoni aldehyde dehydrogenase 0.0038 0.009 0.0307
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.004 0.0098 0.0561
Loa Loa (eye worm) hypothetical protein 0.004 0.0098 0.0561
Toxoplasma gondii FATC domain-containing protein 0.0118 0.0358 0.5324
Echinococcus granulosus L aminoadipate semialdehyde 0.005 0.0131 0.0131
Entamoeba histolytica hypothetical protein 0.0023 0.0041 0.0467
Brugia malayi CXXC zinc finger family protein 0.0035 0.0081 0.0301
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.004 0.0098 0.0098
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0075 0.0213 0.0213
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Echinococcus multilocularis dnaJ subfamily B 0.05 0.164 0.164
Schistosoma mansoni cpg binding protein 0.0037 0.0088 0.0297
Loa Loa (eye worm) phosphatidylinositol 3 0.004 0.0098 0.0561
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0209 0.0663 0.368
Echinococcus multilocularis epidermal growth factor receptor 0.0097 0.0288 0.0288
Schistosoma mansoni tyrosine kinase 0.0097 0.0288 0.1311
Leishmania major hypothetical protein, conserved 0.1088 0.3608 1
Plasmodium vivax hypothetical protein, conserved 0.004 0.0098 0.4315
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.004 0.0098 0.0098
Entamoeba histolytica protein kinase, putative 0.0075 0.0213 0.3105
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0075 0.0213 0.0213
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0209 0.0663 0.3214
Loa Loa (eye worm) hypothetical protein 0.0078 0.0223 0.1276
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0209 0.0663 0.1812
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.004 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.004 0.0098 0.0561
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.004 0.0098 0.4315
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.002 0.0029 0.0029
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0209 0.0663 0.3214
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0209 0.0663 0.1673
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0075 0.0213 0.3105
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.002 0.0029 0.0029
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.002 0.0029 0.0029
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0097 0.0288 0.0288
Echinococcus granulosus neuropeptide s receptor 0.0269 0.0865 0.0865
Leishmania major protein kinase, putative 0.0075 0.0213 0.0563
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Schistosoma mansoni tyrosine kinase 0.0097 0.0288 0.1311
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0131 0.0403 0.6015
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Plasmodium vivax calcium-dependent protein kinase, putative 0.0075 0.0213 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0058 0.0156 0.0156
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.015 0.0467 0.2543
Schistosoma mansoni hypothetical protein 0.004 0.0098 0.0348
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.004 0.0098 0.0348
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Schistosoma mansoni hypothetical protein 0.0042 0.0106 0.0388
Plasmodium falciparum calcium-dependent protein kinase 1 0.0075 0.0213 1
Entamoeba histolytica hypothetical protein 0.004 0.0098 0.1339
Trichomonas vaginalis glucosylceramidase, putative 0.0104 0.0312 0.3783
Schistosoma mansoni hypothetical protein 0.0099 0.0294 0.1342
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0075 0.0213 0.0213
Echinococcus granulosus dnaJ subfamily B 0.05 0.164 0.164
Mycobacterium ulcerans aldehyde dehydrogenase 0.0038 0.009 1
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase subunit type II alpha 0.0533 0.175 1
Mycobacterium leprae conserved hypothetical protein 0.004 0.0098 1
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0014 0.0011 0.5
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.002 0.0029 0.0029
Schistosoma mansoni hypothetical protein 0.0091 0.0268 0.1213
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.0098 0.1339
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Echinococcus multilocularis insulin receptor 0.0058 0.0156 0.0156
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.004 0.0098 0.0098
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0023 0.0041 0.0041
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.0098 0.1339
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.005 0.0131 0.0592
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0091 0.0268 0.0268
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0118 0.0358 0.1667
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Plasmodium falciparum calcium-dependent protein kinase 3 0.0075 0.0213 1
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.015 0.0467 0.2669
Echinococcus granulosus calcium dependent protein kinase 0.0072 0.0206 0.0206
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Echinococcus granulosus geminin 0.0099 0.0294 0.0294
Leishmania major phosphatidylinositol 4-kinase, putative 0.004 0.0098 0.0243
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0209 0.0663 0.1673
Loa Loa (eye worm) hypothetical protein 0.0091 0.0268 0.1534
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.004 0.0098 0.0098
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.4315
Trypanosoma cruzi target of rapamycin kinase 3 0.0209 0.0663 0.1673
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0209 0.0663 0.0663
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0209 0.0663 1
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0075 0.0213 0.1218
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.004 0.0098 0.1339
Loa Loa (eye worm) phosphatidylinositol 3 0.0209 0.0663 0.3787
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Schistosoma mansoni hypothetical protein 0.0099 0.0294 0.1342
Echinococcus multilocularis neuropeptide receptor A26 0.0269 0.0865 0.0865
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Schistosoma mansoni cpg binding protein 0.0035 0.0081 0.0263
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.0098 0.1339
Plasmodium falciparum phosphatidylinositol 3-kinase 0.004 0.0098 0.4315
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.2996 1 1
Entamoeba histolytica hypothetical protein 0.0023 0.0041 0.0467
Leishmania major phosphatidylinositol kinase, putative 0.004 0.0098 0.0243
Trypanosoma cruzi hypothetical protein, conserved 0.1048 0.3474 1
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.004 0.0098 0.0098
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0209 0.0663 0.0663
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.004 0.0098 0.0348
Entamoeba histolytica hypothetical protein 0.004 0.0098 0.1339
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0608 0.2 0.2
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0081 0.0464
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.004 0.0098 0.1339
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0075 0.0213 1
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0075 0.0213 0.0213
Loa Loa (eye worm) phosphatidylinositol 3 0.004 0.0098 0.0561
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0209 0.0663 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Trichomonas vaginalis conserved hypothetical protein 0.0078 0.0223 0.2219
Loa Loa (eye worm) hypothetical protein 0.005 0.0131 0.075
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.0098 0.1339
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0209 0.0663 1
Brugia malayi Protein kinase domain containing protein 0.0058 0.0156 0.0738
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0038 0.009 0.022
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0075 0.0213 0.3105
Echinococcus multilocularis epidermal growth factor receptor 0.018 0.0567 0.0567
Plasmodium falciparum calcium-dependent protein kinase 2 0.0075 0.0213 1
Schistosoma mansoni protein kinase 0.0608 0.2 1
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0075 0.0213 1
Echinococcus multilocularis geminin 0.0099 0.0294 0.0294
Trichomonas vaginalis conserved hypothetical protein 0.0091 0.0268 0.3017
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0091 0.0268 0.0268
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.004 0.0098 0.1339
Trichomonas vaginalis glucosylceramidase, putative 0.0104 0.0312 0.3783
Entamoeba histolytica hypothetical protein 0.004 0.0098 0.1339
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Schistosoma mansoni transcription factor LCR-F1 0.0023 0.0041 0.006
Brugia malayi Cam kinase protein 1 0.0075 0.0213 0.1068
Toxoplasma gondii target of rapamycin (TOR), putative 0.0209 0.0663 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0062 0.0172 0.0827
Brugia malayi hypothetical protein 0.0023 0.0041 0.0068
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Schistosoma mansoni tyrosine kinase 0.0058 0.0156 0.0644
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.004 0.0098 0.1339
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0014 0.0011 0.5
Leishmania major phosphatidylinositol 3-related kinase, putative 0.0209 0.0663 0.1812
Echinococcus granulosus GPCR family 2 0.002 0.0029 0.0029
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis glucosylceramidase, putative 0.015 0.0467 0.6534
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0118 0.0358 0.077
Schistosoma mansoni tyrosine kinase 0.0096 0.0284 0.1294
Echinococcus granulosus epidermal growth factor receptor 0.018 0.0567 0.0567
Echinococcus multilocularis 0.004 0.0098 0.0098
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.004 0.0098 0.0098
Trichomonas vaginalis glucosylceramidase, putative 0.0099 0.0294 0.3468
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Loa Loa (eye worm) phosphatidylinositol 3 0.004 0.0098 0.0561
Toxoplasma gondii aldehyde dehydrogenase 0.0038 0.009 0.1214
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0075 0.0213 0.3105
Plasmodium falciparum calcium-dependent protein kinase 4 0.0075 0.0213 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0023 0.0041 0.0041
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.004 0.0098 0.0348
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.004 0.0098 0.0098
Trichomonas vaginalis PIKK family atypical protein kinase 0.0118 0.0358 0.4601
Echinococcus granulosus serine protein kinase ATM 0.0118 0.0358 0.0358
Leishmania major phosphatidylinositol 3-kinase, putative 0.0209 0.0663 0.1812
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.004 0.0098 0.0098
Schistosoma mansoni hypothetical protein 0.05 0.164 0.8172
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0209 0.0663 1
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.004 0.0098 0.0348
Echinococcus multilocularis L aminoadipate semialdehyde 0.005 0.0131 0.0131
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0118 0.0358 0.1909
Loa Loa (eye worm) latrophilin receptor protein 2 0.002 0.0029 0.0168
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.004 0.0098 0.0098
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0118 0.0358 0.1909
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.004 0.0098 0.1339
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.004 0.0098 0.0399
Mycobacterium ulcerans aldehyde dehydrogenase 0.0038 0.009 1
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0058 0.0156 0.0156
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0075 0.0213 0.0213
Brugia malayi FAT domain containing protein 0.0091 0.0268 0.1389
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0209 0.0663 0.0663
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0075 0.0213 0.0933
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.004 0.0098 0.1339
Loa Loa (eye worm) hypothetical protein 0.0042 0.0106 0.0605
Toxoplasma gondii histone lysine methyltransferase SET1 0.0067 0.0187 0.2696
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Loa Loa (eye worm) hypothetical protein 0.0131 0.0403 0.2302
Brugia malayi latrophilin 2 splice variant baaae 0.0042 0.0106 0.0444
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0209 0.0663 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.004 0.0098 0.0399
Onchocerca volvulus 0.005 0.0131 0.2354
Leishmania major phosphatidylinositol kinase related protein, putative 0.004 0.0098 0.0243
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0533 0.175 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0209 0.0663 0.3787
Echinococcus multilocularis GPCR, family 2 0.002 0.0029 0.0029
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.004 0.0098 0.4315
Trichomonas vaginalis PIKK family atypical protein kinase 0.0131 0.0403 0.5399
Loa Loa (eye worm) TK/INSR protein kinase 0.0058 0.0156 0.0893
Brugia malayi Calcitonin receptor-like protein seb-1 0.0062 0.0172 0.0827
Schistosoma mansoni serine/threonine protein kinase 0.0075 0.0213 0.0932
Echinococcus multilocularis serine protein kinase ATM 0.0118 0.0358 0.0358
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0209 0.0663 1

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 221 nM Inhibition of LPS-stimulated TNFalpha production in monocytes ChEMBL. 17715908
Activity (functional) = 3080 nM Inhibition of LPS-stimulated TNFalpha production in human blood ChEMBL. 17715908
Activity (functional) = 3080 nM Inhibition of LPS-stimulated TNFalpha production in human blood ChEMBL. 17715908
AUC/dose (ADMET) < 10 ng.hr.kg/mg/ml AUC (0 to infinity) in Sprague-Dawley rat at 25 mg/kg, po ChEMBL. 17715908
CL (ADMET) 0 Plasma clearance in Sprague-Dawley rat at 5 mg/kg, iv ChEMBL. 17715908
F (ADMET) 0 Bioavailability in Sprague-Dawley rat at 25 mg/kg, po ChEMBL. 17715908
IC50 (binding) = 20 nM Inhibition of Tpl2 by ELISA ChEMBL. 17715908
IC50 (binding) = 20 nM Inhibition of Tpl2 by ELISA ChEMBL. 17715908
IC50 (functional) > 5000 nM Inhibition of P-EGFR expressed in A431 cells ChEMBL. 17715908
IC50 (functional) > 5000 nM Inhibition of P-EGFR expressed in A431 cells ChEMBL. 17715908
IC50 (binding) = 5.6 uM Inhibition of CAMK2 ChEMBL. 17715908
IC50 (binding) = 5.6 uM Inhibition of CAMK2 ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of p38alpha ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of PKCalpha ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of PKA ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of MK2 ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of Src ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of S6K ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of Jnk1 ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of p38alpha ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of PKCalpha ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of PKA ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of MK2 ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of Src ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of S6K ChEMBL. 17715908
IC50 (binding) > 40 uM Inhibition of Jnk1 ChEMBL. 17715908
Inhibition (ADMET) = 66 % Inhibition of CYP3A4 at 3 uM ChEMBL. 17715908
Inhibition (ADMET) = 66 % Inhibition of CYP3A4 at 3 uM ChEMBL. 17715908
t1/2 (ADMET) 0 Half life in Sprague-Dawley rat at 5 mg/kg, iv ChEMBL. 17715908
t1/2 (ADMET) = 2.6 hr Half life in Sprague-Dawley rat at 25 mg/kg, po ChEMBL. 17715908
Vss (ADMET) 0 Volume of distribution at steady state in Sprague-Dawley rat at 5 mg/kg, iv ChEMBL. 17715908

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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