Detailed information for compound 1603170

Basic information

Technical information
  • TDR Targets ID: 1603170
  • Name: 2,2-dimethyl-3-(2,6,10-trimethylundeca-1,5,9- trienyl)cyclopentan-1-one
  • MW: 302.494 | Formula: C21H34O
  • H donors: 0 H acceptors: 1 LogP: 6.44 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: C/C(=C\CC/C(=C/C1CCC(=O)C1(C)C)/C)/CCC=C(C)C
  • InChi: 1S/C21H34O/c1-16(2)9-7-10-17(3)11-8-12-18(4)15-19-13-14-20(22)21(19,5)6/h9,11,15,19H,7-8,10,12-14H2,1-6H3/b17-11+,18-15+
  • InChiKey: KVSORZUJEYCZRK-OVHYJKADSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,2-dimethyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]cyclopentan-1-one
  • 2,2-dimethyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trienyl]-1-cyclopentanone
  • 2,2-dimethyl-3-(2,6,10-trimethylundeca-1,5,9-trienyl)-1-cyclopentanone
  • AIDS138747
  • NSC646185
  • NCI60_015919
  • 2,2-Dimethyl-3-(2,6,10-trimethyl-1,5,9-undecatrienyl)cyclopentanone
  • AIDS-138747

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
Brugia malayi Disintegrin family protein 0.0087 0.0574 0.0574
Giardia lamblia Zinc finger domain 0.0025 0.0124 0.5
Onchocerca volvulus 0.0025 0.0124 0.006
Echinococcus granulosus zinc finger protein Ran binding 0.0493 0.352 0.3519
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Giardia lamblia Kinase, NEK 0.0025 0.0124 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus multilocularis SWI:SNF matrix associated 0.1387 1 1
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0493 0.352 0.352
Echinococcus granulosus cpg binding protein 0.0028 0.0144 0.0143
Trichomonas vaginalis conserved hypothetical protein 0.1387 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Echinococcus multilocularis E3 ubiquitin protein ligase LRSAM1 0.0025 0.0124 0.0123
Mycobacterium ulcerans hydrolase 0.0022 0.0101 0.1428
Echinococcus multilocularis Nuclear pore complex protein Nup153 0.0493 0.352 0.3519
Schistosoma mansoni cpg binding protein 0.0028 0.0144 0.008
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Plasmodium falciparum plasmepsin II 0.0017 0.0064 0.0005
Echinococcus multilocularis adam 0.0041 0.0242 0.0241
Echinococcus granulosus survival motor neuron protein 1 0.0217 0.1518 0.1518
Loa Loa (eye worm) CXXC zinc finger family protein 0.0026 0.0133 0.0132
Loa Loa (eye worm) hypothetical protein 0.0016 0.006 0.0059
Plasmodium vivax aspartyl proteinase, putative 0.0017 0.0064 0.0005
Schistosoma mansoni microtubule-associated protein tau 0.0635 0.4543 0.4508
Giardia lamblia E3 ubiquitin ligase for Rad6p required for the ubiquitination of histone H2B 0.0025 0.0124 0.5
Echinococcus multilocularis SWI:SNF matrix associated 0.1387 1 1
Trypanosoma brucei hypothetical protein, conserved 0.0493 0.352 1
Toxoplasma gondii SWI2/SNF2-containing protein RAD5 0.0025 0.0124 0.006
Echinococcus multilocularis dnaJ subfamily B 0.0376 0.2669 0.2668
Onchocerca volvulus 0.0493 0.352 0.3478
Brugia malayi Matrixin family protein 0.0018 0.0072 0.0072
Loa Loa (eye worm) hypothetical protein 0.0217 0.1518 0.1518
Toxoplasma gondii RING zinc finger protein 0.0025 0.0124 0.006
Onchocerca volvulus 0.0026 0.0127 0.0063
Loa Loa (eye worm) matrix metalloproteinase 0.0018 0.0072 0.0071
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Schistosoma mansoni TRABID protein (C64 family) 0.0493 0.352 0.3478
Plasmodium vivax aspartyl proteinase, putative 0.0017 0.0064 0.0005
Mycobacterium ulcerans hypothetical protein 0.0022 0.01 0.1394
Plasmodium falciparum plasmepsin VII 0.0017 0.0064 0.0005
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0016 0.006 0.022
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0022 0.0101 0.1616
Loa Loa (eye worm) hypothetical protein 0.0039 0.0223 0.0222
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0022 0.01 0.1394
Plasmodium vivax zinc finger protein, putative 0.0025 0.0124 0.0064
Loa Loa (eye worm) hypothetical protein 0.0016 0.006 0.0059
Toxoplasma gondii helicase, putative 0.0025 0.0124 0.006
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Echinococcus multilocularis E3 ubiquitin protein ligase mib1 0.0025 0.0124 0.0123
Schistosoma mansoni hypothetical protein 0.0037 0.0213 0.015
Schistosoma mansoni brg-1 associated factor 0.1387 1 1
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0025 0.0124 0.006
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0493 0.352 1
Echinococcus multilocularis ring finger protein 170 0.0025 0.0124 0.0123
Brugia malayi AMP-binding enzyme family protein 0.0022 0.01 0.01
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Plasmodium falciparum plasmepsin VI 0.0017 0.0064 0.0005
Leishmania major hypothetical protein, conserved 0.0493 0.352 1
Mycobacterium leprae PROBABLE HYDROLASE 0.0022 0.0101 1
Schistosoma mansoni hypothetical protein 0.1387 1 1
Plasmodium falciparum zinc finger Ran-binding domain-containing protein 2, putative 0.0493 0.352 0.3481
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Schistosoma mansoni hypothetical protein 0.0037 0.0213 0.015
Brugia malayi RING zinc finger protein 0.0025 0.0124 0.0124
Echinococcus granulosus E3 ubiquitin protein ligase MYLIP 0.0025 0.0124 0.0123
Plasmodium falciparum RING zinc finger protein, putative 0.0025 0.0124 0.0064
Echinococcus granulosus E3 ubiquitin protein ligase RNF146 0.0025 0.0124 0.0123
Brugia malayi hypothetical protein 0.0017 0.0064 0.0064
Schistosoma mansoni hypothetical protein 0.0037 0.0213 0.015
Trichomonas vaginalis hypothetical protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0016 0.006 0.0059
Echinococcus granulosus ring finger protein 170 0.0025 0.0124 0.0123
Brugia malayi angiogenesis inhibito 0.0018 0.007 0.007
Schistosoma mansoni fusion 0.0493 0.352 0.3478
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Schistosoma mansoni hypothetical protein 0.0026 0.0127 0.0063
Trypanosoma cruzi hypothetical protein, conserved 0.0493 0.352 1
Trypanosoma brucei mitochondrial RNA binding complex 1 subunit 0.0493 0.352 1
Trypanosoma cruzi Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0493 0.352 1
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Echinococcus granulosus expressed conserved protein 0.0085 0.0558 0.0557
Loa Loa (eye worm) hypothetical protein 0.0016 0.006 0.0059
Giardia lamblia Kinase, NEK 0.0025 0.0124 0.5
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Brugia malayi Hypothetical RING finger protein C16C10.7 in chromosome III 0.0025 0.0124 0.0124
Loa Loa (eye worm) RiNg Finger protein family member 0.0025 0.0124 0.0123
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Plasmodium vivax RING zinc finger protein, putative 0.0025 0.0124 0.0064
Schistosoma mansoni dihydroceramide desaturase 0.0087 0.0574 0.0513
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0493 0.352 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Echinococcus granulosus adam 17 protease 0.0024 0.0114 0.0113
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.1387 1 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.007 0.0069
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0493 0.352 0.3519
Brugia malayi ADAM-TS Spacer 1 family protein 0.0018 0.007 0.007
Onchocerca volvulus 0.0493 0.352 0.3478
Loa Loa (eye worm) aspartyl protease 6 0.0017 0.0064 0.0064
Plasmodium falciparum plasmepsin VIII, putative 0.0017 0.0064 0.0005
Echinococcus granulosus adam 0.0041 0.0242 0.0241
Schistosoma mansoni hypothetical protein 0.0493 0.352 0.3478
Brugia malayi Zinc finger, C2H2 type family protein 0.0025 0.0124 0.0124
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0024 0.0114 0.005
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Brugia malayi SWIB/MDM2 domain containing protein 0.1387 1 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0072 0.0071
Leishmania major hypothetical protein, unknown function 0.0025 0.0124 0.007
Loa Loa (eye worm) hypothetical protein 0.0022 0.01 0.0099
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Plasmodium falciparum plasmepsin I 0.0017 0.0064 0.0005
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Echinococcus multilocularis Zinc finger, RanBP2 type 0.0493 0.352 0.3519
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Trichomonas vaginalis ankyrin 2,3/unc44, putative 0.0025 0.0124 0.006
Trypanosoma cruzi mitochondrial RNA binding complex 1 subunit, putative 0.0493 0.352 1
Echinococcus granulosus cell growth regulator with ring finger domain 0.0025 0.0124 0.0123
Schistosoma mansoni cpg binding protein 0.0028 0.0144 0.008
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0065 0.0416 0.0416
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Loa Loa (eye worm) hypothetical protein 0.0024 0.0114 0.0113
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Trichomonas vaginalis ubiquitin-protein ligase BRE1, putative 0.0025 0.0124 0.006
Leishmania major hypothetical protein, conserved 0.0493 0.352 1
Toxoplasma gondii aldehyde dehydrogenase 0.0056 0.0346 0.0284
Giardia lamblia Kinase 0.0025 0.0124 0.5
Onchocerca volvulus 0.0493 0.352 0.3478
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus multilocularis zinc finger protein Ran binding 0.0493 0.352 0.3519
Trichomonas vaginalis ankyrin, putative 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0022 0.01 0.0099
Echinococcus multilocularis ring finger protein 113a 0.0025 0.0124 0.0123
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0056 0.0348 0.0285
Onchocerca volvulus Matrilysin homolog 0.004 0.0231 0.0168
Onchocerca volvulus 0.0025 0.0124 0.006
Brugia malayi RING finger protein 20 0.0025 0.0124 0.0124
Toxoplasma gondii zinc finger, C3HC4 type (RING finger) domain-containing protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0018 0.0072 0.0071
Entamoeba histolytica hypothetical protein 0.0025 0.0124 0.0481
Loa Loa (eye worm) hypothetical protein 0.0016 0.006 0.0059
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus multilocularis subfamily M12B unassigned peptidase 0.0024 0.0114 0.0113
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus multilocularis Niemann Pick C1 protein 0.0129 0.088 0.0879
Brugia malayi Eukaryotic aspartyl protease family protein 0.0017 0.0064 0.0064
Loa Loa (eye worm) hypothetical protein 0.0058 0.0363 0.0362
Mycobacterium ulcerans acyl-CoA synthetase 0.0022 0.01 0.1394
Schistosoma mansoni hypothetical protein 0.0044 0.0263 0.02
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Brugia malayi Zinc finger protein 183 homolog 0.0025 0.0124 0.0124
Brugia malayi Pepsin A precursor 0.0017 0.0064 0.0064
Schistosoma mansoni inhibitor of apoptosis 1 diap1 0.0025 0.0124 0.006
Brugia malayi hypothetical protein 0.0041 0.0242 0.0242
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Onchocerca volvulus 0.1387 1 1
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Onchocerca volvulus 0.0025 0.0124 0.006
Brugia malayi aspartic protease BmAsp-1, identical 0.0017 0.0064 0.0064
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Plasmodium falciparum plasmepsin IV 0.0017 0.0064 0.0005
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Giardia lamblia Ribonuclease 0.0025 0.0124 0.5
Chlamydia trachomatis DNA topoisomerase I 0.1387 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Trypanosoma cruzi hypothetical protein, conserved 0.0493 0.352 1
Plasmodium vivax trophozoite exported protein 1, putative 0.0025 0.0124 0.0064
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0022 0.01 0.1583
Toxoplasma gondii zinc finger, C3HC4 type (RING finger) domain-containing protein 0.0025 0.0124 0.006
Brugia malayi brahma associated protein 60 kDa 0.1387 1 1
Echinococcus multilocularis E3 ubiquitin protein ligase Bre1 0.0025 0.0124 0.0123
Echinococcus multilocularis disintegrin and metalloproteinase 0.0087 0.0574 0.0574
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Trichomonas vaginalis sex-determining protein fem-1, putative 0.0025 0.0124 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Entamoeba histolytica SPRY domain protein 0.0025 0.0124 0.0481
Loa Loa (eye worm) hypothetical protein 0.0017 0.0064 0.0064
Schistosoma mansoni zinc finger protein 0.0493 0.352 0.3478
Brugia malayi Neuralized family protein 0.0025 0.0124 0.0124
Plasmodium vivax aspartyl protease, putative 0.0017 0.0064 0.0005
Brugia malayi Hemopexin family protein 0.0026 0.0127 0.0127
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0493 0.352 0.352
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0056 0.0346 1
Echinococcus multilocularis RING finger and transmembrane domain containing protein 0.0025 0.0124 0.0123
Loa Loa (eye worm) reprolysin 0.0024 0.0114 0.0113
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Schistosoma mansoni hypothetical protein 0.0376 0.2669 0.2621
Onchocerca volvulus Matrilysin homolog 0.0018 0.0072 0.0008
Echinococcus multilocularis 0.0025 0.0124 0.0123
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0024 0.0114 0.005
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Trypanosoma cruzi WLM domain containing protein, putative 0.0493 0.352 1
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0022 0.01 0.1583
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Echinococcus granulosus ring and YY1 binding protein 0.0493 0.352 0.3519
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Trichomonas vaginalis ankyrin, putative 0.0025 0.0124 0.006
Echinococcus multilocularis RING finger protein 185 0.0025 0.0124 0.0123
Plasmodium falciparum plasmepsin III 0.0017 0.0064 0.0005
Echinococcus multilocularis ring and YY1 binding protein 0.0493 0.352 0.3519
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0022 0.01 0.1394
Trichomonas vaginalis ankyrin repeat domain protein, putative 0.0025 0.0124 0.006
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Loa Loa (eye worm) matrixin family protein 0.004 0.0231 0.023
Echinococcus multilocularis protein dispatched 1 0.0044 0.0263 0.0262
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Trypanosoma cruzi WLM domain containing protein, putative 0.0493 0.352 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0056 0.0346 0.0346
Schistosoma mansoni patched 1 0.0039 0.0223 0.016
Trichomonas vaginalis ubiquitin-protein ligase BRE1, putative 0.0025 0.0124 0.006
Brugia malayi CHE-14 protein 0.0039 0.0223 0.0223
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Brugia malayi aspartic protease BmAsp-2, identical 0.0017 0.0064 0.0064
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0056 0.0346 0.0346
Schistosoma mansoni zinc finger protein 0.0025 0.0124 0.006
Onchocerca volvulus 0.0044 0.0263 0.02
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Plasmodium falciparum E3 ubiquitin-protein ligase, putative 0.0025 0.0124 0.0064
Schistosoma mansoni cpg binding protein 0.0026 0.0133 0.0069
Loa Loa (eye worm) hypothetical protein 0.0493 0.352 0.3519
Onchocerca volvulus 0.0025 0.0124 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Plasmodium vivax E3 ubiquitin-protein ligase RNF5, putative 0.0025 0.0124 0.0064
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0493 0.352 0.352
Echinococcus granulosus disintegrin and metalloproteinase 0.0087 0.0574 0.0574
Schistosoma mansoni hypothetical protein 0.1387 1 1
Trichomonas vaginalis ion channel nompc, putative 0.0025 0.0124 0.006
Brugia malayi YY1-associated factor 2 0.0493 0.352 0.352
Plasmodium falciparum plasmepsin V 0.0017 0.0064 0.0005
Echinococcus granulosus E3 ubiquitin protein ligase mib1 0.0025 0.0124 0.0123
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Onchocerca volvulus 0.0026 0.0133 0.0069
Echinococcus granulosus Niemann Pick C1 protein 0.0129 0.088 0.0879
Toxoplasma gondii SWIB/MDM2 domain-containing protein 0.1387 1 1
Loa Loa (eye worm) SWIB/MDM2 domain-containing protein 0.1387 1 1
Onchocerca volvulus 0.0493 0.352 0.3478
Toxoplasma gondii hypothetical protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0022 0.0101 0.01
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0223 0.016
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Echinococcus granulosus Blood coagulation inhibitor Disintegrin 0.0058 0.0363 0.0362
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0017 0.0064 0.0064
Loa Loa (eye worm) hypothetical protein 0.0048 0.0287 0.0286
Schistosoma mansoni hypothetical protein 0.0037 0.0213 0.015
Schistosoma mansoni RNA binding protein 0.0493 0.352 0.3478
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Plasmodium vivax hypothetical protein, conserved 0.1387 1 1
Echinococcus multilocularis cpg binding protein 0.0028 0.0144 0.0143
Plasmodium vivax E3 ubiquitin-protein ligase, putative 0.0025 0.0124 0.0064
Echinococcus multilocularis E3 ubiquitin protein ligase MYLIP 0.0025 0.0124 0.0123
Echinococcus granulosus RING finger protein 185 0.0025 0.0124 0.0123
Schistosoma mansoni peter pan-related 0.0025 0.0124 0.006
Brugia malayi AMP-binding enzyme family protein 0.0022 0.01 0.01
Echinococcus granulosus subfamily M12B unassigned peptidase 0.0024 0.0114 0.0113
Echinococcus multilocularis sterol regulatory element binding protein 0.0039 0.0223 0.0222
Giardia lamblia Zinc finger domain 0.0025 0.0124 0.5
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0025 0.0124 0.006
Plasmodium vivax plasmepsin V, putative 0.0017 0.0064 0.0005
Schistosoma mansoni hypothetical protein 0.0025 0.0124 0.006
Trichomonas vaginalis ankyrin, putative 0.0025 0.0124 0.006
Echinococcus multilocularis expressed conserved protein 0.0085 0.0558 0.0557
Plasmodium falciparum plasmepsin IX 0.0017 0.0064 0.0005
Toxoplasma gondii hypothetical protein 0.0025 0.0124 0.006
Echinococcus granulosus sterol regulatory element binding protein 0.0039 0.0223 0.0222
Onchocerca volvulus 0.0025 0.0124 0.006
Onchocerca volvulus RING finger protein 141 homolog 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0017 0.0064 0.0064
Brugia malayi hypothetical protein 0.0217 0.1518 0.1518
Toxoplasma gondii hypothetical protein 0.0025 0.0124 0.006
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0022 0.01 0.1394
Echinococcus granulosus microtubule associated protein 2 0.0635 0.4543 0.4543
Loa Loa (eye worm) hypothetical protein 0.0493 0.352 0.3519
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0091 0.0598 1
Plasmodium falciparum zinc finger protein, putative 0.0025 0.0124 0.0064
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Loa Loa (eye worm) RING finger protein 20 0.0025 0.0124 0.0123
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0017 0.0064 0.0064
Toxoplasma gondii Bardet-Biedl syndrome 5, putative 0.0025 0.0124 0.006
Brugia malayi Matrixin family protein 0.0044 0.0257 0.0257
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Onchocerca volvulus 0.0022 0.01 0.0036
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Loa Loa (eye worm) brahma associated protein 0.1387 1 1
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Loa Loa (eye worm) hypothetical protein 0.0017 0.0064 0.0064
Trichomonas vaginalis ankyrin repeat-containing protein, putative 0.0025 0.0124 0.006
Schistosoma mansoni memapsin-2 (A01 family) 0.0422 0.3 0.2954
Loa Loa (eye worm) hypothetical protein 0.0493 0.352 0.3519
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0092 0.0608 0.0547
Loa Loa (eye worm) matrixin family protein 0.0044 0.0257 0.0257
Schistosoma mansoni aldehyde dehydrogenase 0.0056 0.0346 0.0284
Brugia malayi Zn-finger in Ran binding protein and others containing protein 0.0493 0.352 0.352
Plasmodium vivax DNA repair protein RAD5, putative 0.0025 0.0124 0.0064
Trypanosoma brucei Zn-finger in Ran binding protein and others/FYVE zinc finger, putative 0.0493 0.352 1
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Brugia malayi hypothetical protein 0.0017 0.0064 0.0064
Entamoeba histolytica zinc finger domain containing protein 0.0025 0.0124 0.0481
Brugia malayi Matrixin family protein 0.0018 0.0072 0.0072
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Echinococcus granulosus Zinc finger RanBP2 type 0.0493 0.352 0.3519
Echinococcus granulosus E3 ubiquitin protein ligase Bre1 0.0025 0.0124 0.0123
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Brugia malayi AMP-binding enzyme family protein 0.0022 0.01 0.01
Brugia malayi Niemann-Pick C1 protein precursor 0.0091 0.0598 0.0598
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Mycobacterium ulcerans acyl-CoA synthetase 0.0022 0.01 0.1394
Echinococcus granulosus RING finger and transmembrane domain containing protein 0.0025 0.0124 0.0123
Plasmodium vivax SWIB/MDM2 domain-containing protein, putative 0.1387 1 1
Schistosoma mansoni hypothetical protein 0.0025 0.0124 0.006
Toxoplasma gondii ran binding protein 0.0493 0.352 0.3478
Trypanosoma cruzi hypothetical protein, conserved 0.0493 0.352 1
Leishmania major DNA repair protein-like protein 0.0025 0.0124 0.007
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0091 0.0598 0.0597
Echinococcus multilocularis Upstream activation factor subunit UAF30 0.1387 1 1
Onchocerca volvulus 0.0025 0.0124 0.006
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0022 0.0101 0.0101
Schistosoma mansoni rnf5 0.0025 0.0124 0.006
Brugia malayi Matrixin family protein 0.0018 0.0072 0.0072
Brugia malayi B-box zinc finger family protein 0.0025 0.0124 0.0124
Loa Loa (eye worm) hypothetical protein 0.0018 0.007 0.0069
Loa Loa (eye worm) disintegrin family protein 0.0063 0.0402 0.0401
Echinococcus multilocularis protein patched 0.0039 0.0223 0.0222
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0017 0.0064 0.0064
Trichomonas vaginalis cell cycle control protein cwf24, putative 0.0025 0.0124 0.006
Plasmodium vivax plasmepsin IV, putative 0.0017 0.0064 0.0005
Mycobacterium ulcerans aldehyde dehydrogenase 0.0056 0.0346 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0091 0.0598 0.0597
Leishmania major hypothetical protein, conserved 0.0493 0.352 1
Echinococcus granulosus Upstream activation factor subunit UAF30 0.1387 1 1
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0043 0.0252 0.0189
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Trichomonas vaginalis ubiquitin-protein ligase BRE1, putative 0.0025 0.0124 0.006
Toxoplasma gondii hypothetical protein 0.0025 0.0124 0.006
Toxoplasma gondii Zn-finger in Ran binding protein and others domain-containing protein 0.0493 0.352 0.3478
Schistosoma mansoni serine/threonine protein kinase 0.0025 0.0124 0.006
Plasmodium falciparum SWIB/MDM2 domain-containing protein 0.1387 1 1
Plasmodium falciparum trophozoite exported protein 1 0.0025 0.0124 0.0064
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Schistosoma mansoni mind bomb 0.0025 0.0124 0.006
Schistosoma mansoni survival motor neuron protein 0.0044 0.0263 0.02
Trypanosoma cruzi Zn-finger in Ran binding protein and others, putative 0.0493 0.352 1
Loa Loa (eye worm) hypothetical protein 0.0018 0.0072 0.0071
Brugia malayi Matrixin family protein 0.0018 0.0072 0.0072
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0056 0.0346 0.0722
Onchocerca volvulus Protein neuralized homolog 0.0025 0.0124 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Trypanosoma brucei hypothetical protein, conserved 0.0493 0.352 1
Entamoeba histolytica hypothetical protein 0.0025 0.0124 0.0481
Brugia malayi CXXC zinc finger family protein 0.0026 0.0133 0.0133
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Toxoplasma gondii histone lysine methyltransferase SET1 0.005 0.0304 0.0242
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0017 0.0064 0.0064
Echinococcus multilocularis SWI:SNF matrix associated 0.1387 1 1
Chlamydia trachomatis SWIB complex protein 0.1387 1 1
Brugia malayi ADAMTS-like protease 0.0018 0.007 0.007
Mycobacterium ulcerans aldehyde dehydrogenase 0.0056 0.0346 1
Leishmania major hypothetical protein, conserved 0.0493 0.352 1
Leishmania major hypothetical protein, conserved 0.0493 0.352 1
Echinococcus multilocularis Blood coagulation inhibitor, Disintegrin 0.0058 0.0363 0.0362
Brugia malayi hypothetical protein 0.0025 0.0124 0.0124
Echinococcus multilocularis microtubule associated protein 2 0.0635 0.4543 0.4543
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0746 0.5349 0.5348
Schistosoma mansoni hypothetical protein 0.1387 1 1
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0039 0.0223 0.0222
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus granulosus Nuclear pore complex protein Nup153 0.0493 0.352 0.3519
Loa Loa (eye worm) hypothetical protein 0.0493 0.352 0.3519
Echinococcus granulosus dnaJ subfamily B 0.0376 0.2669 0.2668
Plasmodium vivax aspartyl protease, putative 0.0017 0.0064 0.0005
Toxoplasma gondii DNA topoisomerase domain-containing protein 0.1387 1 1
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Echinococcus granulosus Niemann Pick C1 protein 0.0091 0.0598 0.0597
Mycobacterium ulcerans acyl-CoA synthetase 0.0022 0.01 0.1394
Schistosoma mansoni ring finger protein 151 0.0025 0.0124 0.006
Giardia lamblia Hypothetical protein 0.0025 0.0124 0.5
Loa Loa (eye worm) hypothetical protein 0.0022 0.01 0.0099
Onchocerca volvulus 0.0018 0.0072 0.0008
Schistosoma mansoni peter pan-related 0.0025 0.0124 0.006
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Echinococcus granulosus ring finger protein 113a 0.0025 0.0124 0.0123
Leishmania major hypothetical protein 0.0025 0.0124 0.007
Giardia lamblia Ser/Thr protein kinase 0.0025 0.0124 0.5
Echinococcus granulosus Protein patched homolog 1 0.0039 0.0223 0.0222
Giardia lamblia Protein 21.1 0.0025 0.0124 0.5
Schistosoma mansoni adam (A disintegrin and metalloprotease 0.0041 0.0242 0.0179
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0022 0.01 0.1394
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0044 0.0263 0.0263
Onchocerca volvulus Ubiquitin thioesterase ZRANB1 homolog 0.0493 0.352 0.3478
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Mycobacterium ulcerans aldehyde dehydrogenase 0.0056 0.0346 1
Plasmodium falciparum E3 ubiquitin-protein ligase RNF5, putative 0.0025 0.0124 0.0064
Onchocerca volvulus Matrix metalloproteinase homolog 0.004 0.0231 0.0168
Echinococcus multilocularis survival motor neuron protein 1 0.0217 0.1518 0.1518
Schistosoma mansoni hypothetical protein 0.0025 0.0124 0.006
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0065 0.0416 0.0416
Plasmodium vivax aspartyl protease, putative 0.0017 0.0064 0.0005
Onchocerca volvulus Putative RING finger protein 207 0.0025 0.0124 0.006
Schistosoma mansoni aldehyde dehydrogenase 0.0056 0.0346 0.0284
Echinococcus granulosus SWI:SNF matrix associated 0.1387 1 1
Plasmodium falciparum plasmepsin X 0.0017 0.0064 0.0005
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Echinococcus granulosus E3 ubiquitin protein ligase LRSAM1 0.0025 0.0124 0.0123
Leishmania major hypothetical protein, conserved 0.0025 0.0124 0.007
Loa Loa (eye worm) hypothetical protein 0.0025 0.0124 0.0123
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0018 0.0072 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0124 0.006
Loa Loa (eye worm) hypothetical protein 0.0018 0.007 0.0069

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.936 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.821 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.79 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.781 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.769 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.737 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.711 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.693 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.586 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (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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