Detailed information for compound 1311011

Basic information

Technical information
  • TDR Targets ID: 1311011
  • Name: N-[2-[3-[2-oxo-2-(oxolan-2-ylmethylamino)ethy l]sulfanylindol-1-yl]ethyl]thiophene-2-carbox amide
  • MW: 443.582 | Formula: C22H25N3O3S2
  • H donors: 2 H acceptors: 2 LogP: 3.18 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CSc1cn(c2c1cccc2)CCNC(=O)c1cccs1)NCC1CCCO1
  • InChi: 1S/C22H25N3O3S2/c26-21(24-13-16-5-3-11-28-16)15-30-20-14-25(18-7-2-1-6-17(18)20)10-9-23-22(27)19-8-4-12-29-19/h1-2,4,6-8,12,14,16H,3,5,9-11,13,15H2,(H,23,27)(H,24,26)
  • InChiKey: MTYFPMXVVIGDEP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[2-[3-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide
  • N-[2-[3-[[2-oxo-2-(2-tetrahydrofuranylmethylamino)ethyl]thio]-1-indolyl]ethyl]-2-thiophenecarboxamide
  • N-[2-[3-[[2-keto-2-(tetrahydrofurfurylamino)ethyl]thio]indol-1-yl]ethyl]thiophene-2-carboxamide
  • MLS000101720
  • SMR000017514

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-49 0.002 0.0087 0.0087
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0001 0.0001
Loa Loa (eye worm) cyclin domain-containing protein 0.0165 0.2904 1
Echinococcus multilocularis dna polymerase eta 0.0019 0.0069 0.0069
Toxoplasma gondii hypothetical protein 0.004 0.0481 0.2548
Mycobacterium leprae Conserved hypothetical protein 0.0529 1 0.5
Trichomonas vaginalis cyclins, putative 0.0103 0.1701 0.1644
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.1552 0.9119
Echinococcus multilocularis G2:mitotic specific cyclin B3 0.0165 0.2904 0.2904
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0069 0.0402
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.002 0.0087 0.0087
Onchocerca volvulus Serine\/threonine kinase homolog 0.0095 0.1552 0.1478
Loa Loa (eye worm) hypothetical protein 0.0043 0.0526 0.181
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.002 0.0087 0.0087
Echinococcus multilocularis cyclin dependent kinase 5 0.0044 0.0547 0.0547
Schistosoma mansoni serine/threonine protein kinase 0.0044 0.0547 0.0547
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.062 0.0555
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Schistosoma mansoni RAR-like nuclear receptor 0.002 0.0087 0.0087
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0044 0.0547 0.1882
Trypanosoma brucei polo-like protein kinase 0.0095 0.1552 0.9119
Echinococcus multilocularis kinase protein 0.0089 0.1434 0.1434
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.062 0.0555
Schistosoma mansoni hypothetical protein 0.0034 0.0357 0.0357
Loa Loa (eye worm) TKL/MLK/TAK1 protein kinase 0.009 0.1454 0.5007
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.002 0.0087 0.0087
Echinococcus granulosus cyclin B 0.0103 0.1701 0.1701
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0665 0.0665
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0089 0.1434 0.1434
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0665 0.0665
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Plasmodium falciparum cyclin 0.0053 0.0732 0.3587
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0069 0.0069
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0095 0.1552 0.1552
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.002 0.0087 0.0299
Schistosoma mansoni cyclins 0.0053 0.0732 0.0732
Brugia malayi Nuclear hormone receptor family member nhr-41 0.002 0.0087 0.0087
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Giardia lamblia Kinase, PLK 0.0095 0.1552 0.1493
Brugia malayi Nuclear hormone receptor family member nhr-40 0.002 0.0087 0.0087
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0665 0.2291
Echinococcus granulosus cyclin dependent kinase 0.0044 0.0547 0.0547
Loa Loa (eye worm) hypothetical protein 0.005 0.0662 0.2278
Loa Loa (eye worm) steroid hormone receptor 0.002 0.0087 0.0299
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0087 0.0087
Echinococcus multilocularis ecdysone induced protein 78C 0.002 0.0087 0.0087
Schistosoma mansoni steroid hormone receptor ad4bp 0.002 0.0087 0.0087
Schistosoma mansoni thyroid hormone receptor 0.002 0.0087 0.0087
Echinococcus granulosus cyclins 0.0053 0.0732 0.0732
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0001 0.0001
Schistosoma mansoni cyclin B 0.0103 0.1701 0.1701
Brugia malayi Nuclear hormone receptor family member nhr-1 0.002 0.0087 0.0087
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.002 0.0087 0.0299
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.002 0.0087 0.0299
Plasmodium falciparum MO15-related protein kinase 0.012 0.2039 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0087 0.0087
Mycobacterium tuberculosis Conserved hypothetical protein 0.0529 1 1
Entamoeba histolytica cell division protein kinase 2, putative 0.0044 0.0547 0.2926
Schistosoma mansoni retinoid-x-receptor (RXR) 0.002 0.0087 0.0087
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0069 0.0068
Mycobacterium leprae Conserved hypothetical protein 0.0529 1 0.5
Trichomonas vaginalis cyclin B, putative 0.0103 0.1701 0.1644
Echinococcus multilocularis cyclin dependent kinase 0.0044 0.0547 0.0547
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0001 0.0001
Echinococcus granulosus G2:mitotic specific cyclin B3 0.0165 0.2904 0.2904
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0044 0.0547 0.2897
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Giardia lamblia Kinase, CMGC CDK 0.0044 0.0547 0.0481
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Trichomonas vaginalis cyclin B, putative 0.0103 0.1701 0.1644
Schistosoma mansoni hypothetical protein 0.0529 1 1
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0547 0.0481
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0069 0.0402
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0069 0.0069
Echinococcus granulosus cyclin dependent kinase 5 0.0044 0.0547 0.0547
Entamoeba histolytica cell division protein kinase 2, putative 0.0052 0.07 0.3867
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0087 0.0087
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Onchocerca volvulus 0.0103 0.1701 0.1629
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0087 0.0087
Mycobacterium tuberculosis Conserved protein 0.0529 1 1
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0044 0.0547 0.1882
Brugia malayi Nuclear hormone receptor family member nhr-3 0.002 0.0087 0.0087
Echinococcus multilocularis cyclin b3 0.0053 0.0732 0.0732
Entamoeba histolytica serine/threonine protein kinase, putative 0.0095 0.1552 0.9082
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0069 0.0069
Brugia malayi photoreceptor-specific nuclear receptor 0.002 0.0087 0.0087
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.002 0.0087 0.0087
Onchocerca volvulus 0.0529 1 1
Entamoeba histolytica cyclin, putative 0.0053 0.0732 0.406
Echinococcus granulosus Transglutaminase 0.0529 1 1
Toxoplasma gondii cell-cycle-associated protein kinase, putative 0.0113 0.1885 1
Entamoeba histolytica cyclin family protein 0.0053 0.0732 0.406
Trichomonas vaginalis cyclins, putative 0.0053 0.0732 0.0667
Loa Loa (eye worm) hypothetical protein 0.0103 0.1701 0.5858
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.002 0.0087 0.0087
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.002 0.0087 0.0087
Echinococcus multilocularis FTZ F1 alpha 0.002 0.0087 0.0087
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Echinococcus granulosus cyclins 0.0053 0.0732 0.0732
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Brugia malayi Nuclear hormone receptor-like 1 0.002 0.0087 0.0087
Echinococcus granulosus 5'partial|3'partial|mitogen activated protein kinase kinase kinase 0.0089 0.1434 0.1434
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0069 0.0069
Trichomonas vaginalis conserved hypothetical protein 0.0053 0.0732 0.0667
Trypanosoma brucei cdc2-related kinase 3 0.0044 0.0547 0.321
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0001 0.0001
Brugia malayi Nuclear hormone receptor family member nhr-31 0.002 0.0087 0.0087
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.002 0.0087 0.0299
Trichomonas vaginalis cyclin B, putative 0.0053 0.0732 0.0667
Trichomonas vaginalis cyclin B, putative 0.0103 0.1701 0.1644
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0087 0.0087
Schistosoma mansoni thyroid hormone receptor 0.002 0.0087 0.0087
Leishmania major cyclin 0.0103 0.1701 1
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Brugia malayi Protein kinase domain containing protein 0.009 0.1454 0.1454
Brugia malayi serine/threonine-protein kinase plk-2 0.0095 0.1552 0.1552
Leishmania major CYC2-like cyclin, putative,cyclin 6, putative 0.0103 0.1701 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.002 0.0087 0.0087
Echinococcus granulosus ecdysone induced protein 78C 0.002 0.0087 0.0087
Echinococcus granulosus cyclin dependent kinase 1 0.0044 0.0547 0.0547
Brugia malayi steroid hormone receptor 0.002 0.0087 0.0087
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0089 0.1434 0.1434
Brugia malayi Nuclear hormone receptor family member nhr-14 0.002 0.0087 0.0087
Brugia malayi cell division control protein 2 homolog 0.0044 0.0547 0.0547
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0069 0.0402
Echinococcus granulosus cyclins 0.0053 0.0732 0.0732
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0001 0.0001
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.002 0.0087 0.0299
Brugia malayi Protein kinase domain containing protein 0.0044 0.0547 0.0547
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.009 0.1454 0.1454
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.002 0.0087 0.0299
Loa Loa (eye worm) hypothetical protein 0.0103 0.1701 0.5858
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0095 0.1552 0.1552
Trypanosoma cruzi cdc2-related kinase 3 0.0044 0.0547 0.321
Trypanosoma brucei mitotic cyclin 6 0.0103 0.1701 1
Schistosoma mansoni nuclear hormone receptor 0.002 0.0087 0.0087
Schistosoma mansoni cyclin B3 0.0165 0.2904 0.2904
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0001 0.0001
Giardia lamblia G2/mitotic-specific cyclin B 0.0103 0.1701 0.1644
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Trypanosoma brucei cdc2-related kinase 1 0.0044 0.0547 0.321
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Brugia malayi Cyclin, N-terminal domain containing protein 0.0165 0.2904 0.2904
Trypanosoma cruzi polo-like protein kinase, putative 0.0095 0.1552 0.9119
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Schistosoma mansoni serine/threonine protein kinase 0.0095 0.1552 0.1552
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Echinococcus multilocularis cyclin dependent kinase 1 0.0044 0.0547 0.0547
Echinococcus granulosus dna polymerase eta 0.0019 0.0069 0.0069
Trypanosoma cruzi cdc2-related kinase 1 0.0044 0.0547 0.321
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Mycobacterium ulcerans putative transglutaminase-like protein 0.0529 1 1
Brugia malayi Cyclin, N-terminal domain containing protein 0.0103 0.1701 0.1701
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Loa Loa (eye worm) hypothetical protein 0.0019 0.0069 0.0237
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.002 0.0087 0.0087
Trichomonas vaginalis cyclin B3, putative 0.0053 0.0732 0.0667
Brugia malayi ecdysteroid receptor 0.002 0.0087 0.0087
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Trypanosoma cruzi CYC2-like cyclin, putative 0.0103 0.1701 1
Brugia malayi Steroid receptor seven-up type 2 0.002 0.0087 0.0087
Giardia lamblia Hypothetical protein 0.0529 1 1
Plasmodium vivax cyclin dependent kinase 7 (cdk7), putative 0.012 0.2039 1
Trichomonas vaginalis cyclins, putative 0.0103 0.1701 0.1644
Echinococcus multilocularis cyclin B 0.0103 0.1701 0.1701
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0357 0.0357
Trypanosoma cruzi cyclin 6, putative 0.0103 0.1701 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Entamoeba histolytica cyclin, putative 0.0103 0.1701 1
Trichomonas vaginalis cyclins, putative 0.0103 0.1701 0.1644
Mycobacterium ulcerans hypothetical protein 0.0529 1 1
Giardia lamblia Hypothetical protein 0.0053 0.0732 0.0667
Mycobacterium tuberculosis Conserved hypothetical protein 0.0529 1 1
Brugia malayi nuclear hormone receptor 0.002 0.0087 0.0087
Echinococcus multilocularis cyclin dependent kinase 1 0.0044 0.0547 0.0547
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Echinococcus multilocularis cyclin B3 1 0.0053 0.0732 0.0732
Mycobacterium ulcerans hypothetical protein 0.0529 1 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0069 0.0402
Echinococcus granulosus nuclear receptor 2DBD gamma 0.002 0.0087 0.0087
Brugia malayi isocitrate dehydrogenase 0.0016 0.0001 0.0001
Schistosoma mansoni DNA polymerase eta 0.0019 0.0069 0.0069
Trichomonas vaginalis peptide N-glycanase, putative 0.0529 1 1
Giardia lamblia Transglutaminase/protease, putative 0.0529 1 1
Mycobacterium ulcerans transglutaminase family protein 0.0529 1 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0001 0.0002
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Loa Loa (eye worm) hypothetical protein 0.005 0.0665 0.2291
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.002 0.0087 0.0299
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0044 0.0547 0.1882
Brugia malayi Nuclear hormone receptor family member nhr-19 0.002 0.0087 0.0087
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0001 0.0001
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0001 0.0001
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.002 0.0087 0.0087
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0069 0.0237
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.002 0.0087 0.0087
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Brugia malayi nuclear receptor NHR-88 0.002 0.0087 0.0087
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0069 0.0402
Leishmania major DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Trypanosoma cruzi cyclin, putative 0.0103 0.1701 1
Leishmania major DNA polymerase eta, putative 0.0019 0.0069 0.0402
Echinococcus multilocularis kinase protein 0.0089 0.1434 0.1434
Loa Loa (eye worm) hypothetical protein 0.0034 0.0357 0.1231
Echinococcus granulosus cyclin B3 1 0.0053 0.0732 0.0732
Trichomonas vaginalis cyclin A, putative 0.0103 0.1701 0.1644
Schistosoma mansoni coup transcription factor 0.002 0.0087 0.0087
Giardia lamblia Cyclin A 0.0053 0.0732 0.0667
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 7 0.0089 0.1434 0.1434
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.1705 0.1648
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0044 0.0547 0.0547
Trypanosoma cruzi cdc2-related kinase 1 0.0044 0.0547 0.321
Trichomonas vaginalis cyclin D, putative 0.0053 0.0732 0.0667
Schistosoma mansoni kinase 0.0049 0.0644 0.0644
Schistosoma mansoni retinoic acid receptor RXR 0.002 0.0087 0.0087
Echinococcus granulosus cyclin b3 0.0053 0.0732 0.0732
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Trichomonas vaginalis cyclins, putative 0.0063 0.0913 0.085
Echinococcus granulosus 3'partial|mitogen activated protein kinase kinase kinase 0.0089 0.1434 0.1434
Entamoeba histolytica cyclin family protein 0.0053 0.0732 0.406
Echinococcus granulosus dna polymerase kappa 0.0019 0.0069 0.0069
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0547 0.0481
Echinococcus granulosus FTZ F1 alpha 0.002 0.0087 0.0087
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0044 0.0547 0.321
Echinococcus granulosus mitogen activated protein kinase kinase kinase 0.009 0.1454 0.1454
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0069 0.0402
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0069 0.0069
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.002 0.0087 0.0087
Schistosoma mansoni serine/threonine protein kinase 0.0044 0.0547 0.0547
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.002 0.0087 0.0087
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0069 0.0069
Trypanosoma cruzi cdc2-related kinase 3 0.0044 0.0547 0.321
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.002 0.0087 0.0087
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0095 0.1552 0.5343
Giardia lamblia Kinase, CMGC CDK 0.0044 0.0547 0.0481
Trichomonas vaginalis cyclin B, putative 0.0103 0.1701 0.1644
Echinococcus granulosus cyclins 0.0053 0.0732 0.0732
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0299
Mycobacterium tuberculosis Hypothetical protein 0.0529 1 1
Trichomonas vaginalis CMGC family protein kinase 0.0044 0.0547 0.0481
Plasmodium vivax protein kinase Crk2 0.0044 0.0547 0.2678
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0095 0.1552 0.9119
Trichomonas vaginalis CAMK family protein kinase 0.0095 0.1552 0.1493
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0069 0.0068
Trypanosoma brucei unspecified product 0.0019 0.0069 0.0402
Brugia malayi Cyclin, N-terminal domain containing protein 0.0103 0.1701 0.1701
Plasmodium falciparum protein kinase 5 0.0044 0.0547 0.2678
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0069 0.0402
Trichomonas vaginalis cyclin D, putative 0.0053 0.0732 0.0667
Echinococcus granulosus retinoic acid receptor rxr beta a 0.002 0.0087 0.0087
Trichomonas vaginalis cyclins, putative 0.0103 0.1701 0.1644
Echinococcus multilocularis thyroid hormone receptor alpha 0.002 0.0087 0.0087
Brugia malayi Nuclear hormone receptor family member nhr-25 0.002 0.0087 0.0087
Mycobacterium tuberculosis Long conserved protein 0.0529 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.002 0.0087 0.0087
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.002 0.0087 0.0087
Echinococcus multilocularis Transglutaminase 0.0529 1 1
Echinococcus multilocularis mitogen activated protein kinase kinase kinase 0.0089 0.1434 0.1434
Echinococcus multilocularis cyclins 0.0053 0.0732 0.0732
Echinococcus granulosus cyclins 0.0053 0.0732 0.0732
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0044 0.0547 0.321
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0069 0.0069
Trypanosoma cruzi cyclin, putative 0.0103 0.1701 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 6.3096 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 28.1838 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor: Activators of Intracellular cAMP Concentrations in Parental HEK 293. (Class of assay: confirmatory) 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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