Detailed information for compound 1441675

Basic information

Technical information
  • TDR Targets ID: 1441675
  • Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl ]-N'-(4-methylpyridin-2-yl)-N-(oxolan-2-ylmet hyl)butanediamide
  • MW: 456.51 | Formula: C24H29FN4O4
  • H donors: 2 H acceptors: 4 LogP: 1.44 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CN(C(=O)CCC(=O)Nc1nccc(c1)C)CC1CCCO1)NCc1ccc(cc1)F
  • InChi: 1S/C24H29FN4O4/c1-17-10-11-26-21(13-17)28-22(30)8-9-24(32)29(15-20-3-2-12-33-20)16-23(31)27-14-18-4-6-19(25)7-5-18/h4-7,10-11,13,20H,2-3,8-9,12,14-16H2,1H3,(H,27,31)(H,26,28,30)
  • InChiKey: HKTGRXSUDITNJX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-N'-(4-methyl-2-pyridyl)-N-(tetrahydrofuran-2-ylmethyl)butanediamide
  • N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-N'-(4-methyl-2-pyridyl)-N-(2-tetrahydrofuranylmethyl)butanediamide
  • N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-N'-(4-methyl-2-pyridyl)-N-(tetrahydrofurfuryl)succinamide
  • N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-N'-(4-methylpyridin-2-yl)-N-(oxolan-2-ylmethyl)butanediamide
  • ASN 05548881

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) phosphatidylinositol 3 0.0437 0.0496 0.0496
Schistosoma mansoni fkbp-rapamycin associated protein 0.1268 0.1777 0.1763
Entamoeba histolytica hypothetical protein 0.1268 0.1777 0.1706
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0437 0.0496 0.0496
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0806 0.1064 0.105
Trichomonas vaginalis PIKK family atypical protein kinase 0.3587 0.5349 0.5309
Toxoplasma gondii target of rapamycin (TOR), putative 0.4925 0.7409 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.6607 1 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0497 0.0589 0.0509
Mycobacterium leprae conserved hypothetical protein 0.0437 0.0496 0.5
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0457 0.0527 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2255 0.3297 0.3239
Entamoeba histolytica hypothetical protein 0.0437 0.0496 0.0414
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.1268 0.1777 0.1706
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.93
Trichomonas vaginalis PIKK family atypical protein kinase 0.5264 0.7931 0.7913
Brugia malayi FAT domain containing protein 0.0976 0.1326 0.1326
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0457 0.0527 0.0445
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0497 0.0589 0.0574
Trichomonas vaginalis PIKK family atypical protein kinase 0.3587 0.5349 0.5309
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0457 0.0527 0.0527
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.6607 1 1
Leishmania major phosphatidylinositol 3-kinase, putative 0.0457 0.0527 0.0445
Leishmania major phosphatidylinositol 3-related kinase, putative 0.2255 0.3297 0.3239
Trichomonas vaginalis PIKK family atypical protein kinase 0.5631 0.8497 0.8484
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0457 0.0527 0.0445
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0457 0.0527 0.0445
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0437 0.0496 0.0496
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.3117 0.4625 0.4579
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0457 0.0527 0.0445
Trichomonas vaginalis PIKK family atypical protein kinase 0.5264 0.7931 0.7913
Trypanosoma cruzi phosphatidylinositol kinase, putative 0.0437 0.0496 0.0414
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.063 0.0794 0.0715
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.056 0.0685 0.0685
Leishmania major phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.0414
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0497 0.0589 0.0509
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.2255 0.3297 0.3239
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.1268 0.1777 0.1763
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.6607 1 1
Loa Loa (eye worm) phosphatidylinositol 3 0.6607 1 1
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.0477 0.0558 0.0477
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0457 0.0527 0.0527
Trichomonas vaginalis PIKK family atypical protein kinase 0.1774 0.2556 0.2492
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.3926 0.5871 0.5835
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0147 0.0049 0.0049
Loa Loa (eye worm) phosphatidylinositol 3 0.0765 0.1001 0.1001
Loa Loa (eye worm) hypothetical protein 0.1338 0.1884 0.1884
Trichomonas vaginalis PIKK family atypical protein kinase 0.4288 0.6428 0.6397
Echinococcus multilocularis fk506 binding protein 0.017 0.0085 0.0085
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0457 0.0527 0.0445
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0437 0.0496 0.0414
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0832 0.1104 0.1028
Trichomonas vaginalis PIKK family atypical protein kinase 0.2244 0.328 0.3222
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.017 0.0085 0.5
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0568 0.0698 0.0618
Leishmania major phosphatidylinositol 3-kinase, putative 0.2244 0.328 0.3222
Trichomonas vaginalis PIKK family atypical protein kinase 0.6607 1 1
Echinococcus granulosus serine:threonine protein kinase SMG1 0.1268 0.1777 0.1777
Trichomonas vaginalis PIKK family atypical protein kinase 0.5264 0.7931 0.7913
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.0414
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.2295 0.3359 0.3359
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0437 0.0496 0.048
Echinococcus multilocularis serine protein kinase ATM 0.1268 0.1777 0.1777
Loa Loa (eye worm) phosphatidylinositol 3 0.0437 0.0496 0.0496
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.2295 0.3359 0.3302
Leishmania major hypothetical protein, conserved 0.0529 0.0638 0.0558
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0457 0.0527 0.0445
Trichomonas vaginalis conserved hypothetical protein 0.0976 0.1326 0.1252
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.2295 0.3359 0.3348
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.056 0.0685 0.0685
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.0414
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0519 0.0623 0.0542
Schistosoma mansoni immunophilin 0.017 0.0085 0.0069
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0193 0.0121 0.0037
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.6607 1 1
Trichomonas vaginalis conserved hypothetical protein 0.1412 0.1999 0.193
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.2295 0.3359 0.3359
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.017 0.0085 0.0085
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.2295 0.3359 0.3359
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.2244 0.328 0.3222
Trichomonas vaginalis PIKK family atypical protein kinase 0.3949 0.5906 0.5871
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.1268 0.1777 0.1706
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0497 0.0589 0.0509
Giardia lamblia GTOR 0.6607 1 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0497 0.0589 0.0589
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0497 0.0589 0.0509
Trichomonas vaginalis PIKK family atypical protein kinase 0.3926 0.5871 0.5835
Entamoeba histolytica phosphatidylinositol 3-kinase 3, putative 0.0437 0.0496 0.0414
Loa Loa (eye worm) phosphatidylinositol 3 0.0437 0.0496 0.0496
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.017 0.0085 0.0085
Loa Loa (eye worm) FKBP5 protein 0.017 0.0085 0.0085
Trichomonas vaginalis PIKK family atypical protein kinase 0.3582 0.534 0.53
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0806 0.1064 0.1064
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0589 0.0731 0.0652
Echinococcus multilocularis PIK kinase, FAT and Armadillo domain containing protein 0.0976 0.1326 0.1326
Trichomonas vaginalis PIKK family atypical protein kinase 0.3949 0.5906 0.5871
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0457 0.0527 0.0527
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0457 0.0527 0.0527
Trichomonas vaginalis conserved hypothetical protein 0.0832 0.1104 0.1028
Trypanosoma cruzi target of rapamycin kinase 3 0.5269 0.794 0.7922
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.063 0.0794 0.0715
Onchocerca volvulus 0.0437 0.0496 0.5
Loa Loa (eye worm) hypothetical protein 0.1268 0.1777 0.1777
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0437 0.0496 0.93
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.063 0.0794 0.0715
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0497 0.0589 0.0509
Echinococcus granulosus serine protein kinase ATM 0.1268 0.1777 0.1777
Trichomonas vaginalis PIKK family atypical protein kinase 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.5264 0.7931 0.7913
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1268 0.1777 0.1777
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0437 0.0496 0.0496
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0697 0.0897 0.0897
Trichomonas vaginalis PIKK family atypical protein kinase 0.3587 0.5349 0.5309
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0457 0.0527 0.0045
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.6607 1 1
Plasmodium vivax hypothetical protein, conserved 0.0437 0.0496 0.93
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0147 0.0049 0.0049
Entamoeba histolytica hypothetical protein 0.0589 0.0731 0.0652
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0437 0.0496 0.0496
Plasmodium vivax phosphatidylinositol 3- and 4-kinase, putative 0.0437 0.0496 0.93
Schistosoma mansoni hypothetical protein 0.0976 0.1326 0.1312
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.5269 0.794 0.7922
Loa Loa (eye worm) hypothetical protein 0.0147 0.0049 0.0049
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0437 0.0496 0.0496
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.93
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Trichomonas vaginalis PIKK family atypical protein kinase 0.4432 0.665 0.6621
Mycobacterium ulcerans FK-506 binding protein, peptidyl-prolyl cis-trans isomerase 0.017 0.0085 0.5
Toxoplasma gondii FATC domain-containing protein 0.1268 0.1777 0.1853
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.6607 1 1
Loa Loa (eye worm) hypothetical protein 0.1412 0.1999 0.1999
Schistosoma mansoni immunophilin 0.017 0.0085 0.0069
Loa Loa (eye worm) hypothetical protein 0.0976 0.1326 0.1326
Giardia lamblia Hypothetical protein 0.0437 0.0496 0.0414
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0437 0.0496 0.048
Leishmania major hypothetical protein, unknown function 0.0437 0.0496 0.0414
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.063 0.0794 0.0794
Trichomonas vaginalis PIKK family atypical protein kinase 0.1279 0.1794 0.1723
Leishmania major phosphatidylinositol kinase related protein, putative 0.0437 0.0496 0.0414
Loa Loa (eye worm) hypothetical protein 0.056 0.0685 0.0685
Loa Loa (eye worm) hypothetical protein 0.0437 0.0496 0.0496
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0497 0.0589 0.0509
Trichomonas vaginalis PIKK family atypical protein kinase 0.6607 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.6607 1 1
Entamoeba histolytica protein kinase rad3, putative 0.1268 0.1777 0.1706
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0437 0.0496 0.0496
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.063 0.0794 0.0715
Onchocerca volvulus 0.0437 0.0496 0.5
Loa Loa (eye worm) hypothetical protein 0.0832 0.1104 0.1104
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.063 0.0794 0.0715
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0176 0.0094 0.0094
Schistosoma mansoni immunophilin 0.0147 0.0049 0.0033
Trypanosoma brucei target of rapamycin kinase 3, putative 0.5269 0.794 0.7922
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.6607 1 1
Toxoplasma gondii non-specific serine/threonine protein kinase 0.1412 0.1999 0.2174
Trichomonas vaginalis PIKK family atypical protein kinase 0.3949 0.5906 0.5871
Echinococcus multilocularis 0.0437 0.0496 0.0496
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Trichomonas vaginalis PIKK family atypical protein kinase 0.3582 0.534 0.53
Plasmodium falciparum phosphatidylinositol 3- and 4-kinase, putative 0.0437 0.0496 0.93
Giardia lamblia Phosphatidylinositol 4-kinase 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0437 0.0496 0.0496
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0457 0.0527 0.0445
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0457 0.0527 0.0527
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0457 0.0527 0.0511
Trypanosoma brucei phosphatidylinositol 3-kinase catalytic subunit, putative 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.6607 1 1
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.2295 0.3359 0.3302
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0457 0.0527 0.0045
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.1268 0.1777 0.1706
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Trichomonas vaginalis PIKK family atypical protein kinase 0.0832 0.1104 0.1028
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.6607 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2244 0.328 0.3222
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0457 0.0527 0.0445
Mycobacterium tuberculosis Conserved hypothetical protein 0.0437 0.0496 0.5
Leishmania major phosphatidylinositol kinase, putative 0.0437 0.0496 0.0414
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0437 0.0496 0.0414
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.2756 0.4068 0.4017
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0568 0.0698 0.0618
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0457 0.0527 0.0445
Echinococcus granulosus PIK kinase FAT and Armadillo domain containing protein 0.0976 0.1326 0.1326
Entamoeba histolytica Phosphatidylinositol 3- and 4-kinase family 0.1279 0.1794 0.1723
Trichomonas vaginalis PIKK family atypical protein kinase 0.2244 0.328 0.3222
Loa Loa (eye worm) phosphatidylinositol kinase 0.0437 0.0496 0.0496
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0497 0.0589 0.0509
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.6607 1 1
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0457 0.0527 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2244 0.328 0.3222
Schistosoma mansoni hypothetical protein 0.0437 0.0496 0.048
Entamoeba histolytica hypothetical protein 0.0437 0.0496 0.0414
Entamoeba histolytica hypothetical protein 0.0437 0.0496 0.0414
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.1268 0.1777 0.1706
Loa Loa (eye worm) phosphatidylinositol 3 0.2255 0.3297 0.3297
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.1268 0.1777 0.1777
Trichomonas vaginalis PIKK family atypical protein kinase 0.3582 0.534 0.53
Loa Loa (eye worm) phosphatidylinositol 3 0.0437 0.0496 0.0496
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.6607 1 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0437 0.0496 0.0496
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0437 0.0496 0.048
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0806 0.1064 0.1064
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0437 0.0496 0.0414
Trichomonas vaginalis PIKK family atypical protein kinase 0.3587 0.5349 0.5309
Trichomonas vaginalis PIKK family atypical protein kinase 0.5264 0.7931 0.7913
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.017 0.0085 0.0085
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.1268 0.1777 0.1777
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.017 0.0085 0.0085
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.017 0.0085 0.0085
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.056 0.0685 0.0685
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.017 0.0085 0.0085
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.063 0.0794 0.0715
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0527 0.0635 0.0554
Plasmodium vivax hypothetical protein 0.0437 0.0496 0.93
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.017 0.0085 0.0069
Echinococcus multilocularis Zinc finger, PHD finger 0.0457 0.0527 0.0527
Trichomonas vaginalis PIKK family atypical protein kinase 0.4925 0.7409 0.7387
Trichomonas vaginalis PIKK family atypical protein kinase 0.1268 0.1777 0.1706
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0697 0.0897 0.0897
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0457 0.0527 0.0511

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 29.0929 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 79.4328 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 3 (EPAC1): primary screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Substrates of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference

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

No literature references available for this target.

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