Detailed information for compound 251011

Basic information

Technical information
  • TDR Targets ID: 251011
  • Name: 3-[5-(3-amino-3-oxopropyl)-1,5,8,12-tetrazabi cyclo[6.6.2]hexadecan-12-yl]propanamide
  • MW: 368.517 | Formula: C18H36N6O2
  • H donors: 2 H acceptors: 2 LogP: -1.67 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: NC(=O)CCN1CCCN2CCN(CC1)CCCN(CC2)CCC(=O)N
  • InChi: 1S/C18H36N6O2/c19-17(25)3-9-21-5-1-7-23-13-12-22(10-4-18(20)26)6-2-8-24(14-11-21)16-15-23/h1-16H2,(H2,19,25)(H2,20,26)
  • InChiKey: BEBMMPLEUZRJRH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-[5-(3-amino-3-oxo-propyl)-1,5,8,12-tetrazabicyclo[6.6.2]hexadecan-12-yl]propanamide
  • 3-[5-(3-azanyl-3-oxo-propyl)-1,5,8,12-tetrazabicyclo[6.6.2]hexadecan-12-yl]propanamide
  • 3-[5-(3-amino-3-keto-propyl)-1,5,8,12-tetrazabicyclo[6.6.2]hexadecan-12-yl]propionamide

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
Echinococcus granulosus tubulin alpha chain 0.0179 0.1936 0.4784
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Echinococcus granulosus jumonji domain containing protein 0.0042 0.0289 0.0696
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.0029 0.0125 0.0117
Echinococcus multilocularis tubulin beta 1 chain 0.0249 0.2778 0.2772
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0076 0.0268
Trichomonas vaginalis tubulin beta chain, putative 0.0074 0.0671 0.1441
Toxoplasma gondii beta-1 tubulin, putative 0.0249 0.2778 1
Schistosoma mansoni lipoxygenase 0.008 0.0743 0.2145
Trypanosoma brucei beta tubulin 0.0249 0.2778 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.2778 0.2772
Trypanosoma cruzi polo-like protein kinase, putative 0.0099 0.0968 0.2181
Loa Loa (eye worm) tubulin alpha 2 0.0122 0.125 0.4437
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0252 0.2817 1
Loa Loa (eye worm) hypothetical protein 0.0179 0.1936 0.6872
Echinococcus granulosus Niemann Pick C1 protein 0.0147 0.1551 0.383
Loa Loa (eye worm) hypothetical protein 0.0105 0.1042 0.3699
Leishmania major beta tubulin 0.0249 0.2778 1
Loa Loa (eye worm) tubulin alpha-2 chain 0.0179 0.1936 0.6872
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0354 0.0346
Trichomonas vaginalis tubulin alpha chain, putative 0.0131 0.1357 0.4176
Echinococcus multilocularis netrin receptor unc 5 0.0029 0.0125 0.0117
Echinococcus multilocularis peregrin 0.0033 0.0175 0.0167
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0076 0.0268
Echinococcus granulosus Tubulin alpha 1 chain 0.0179 0.1936 0.4784
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.2778 0.2772
Plasmodium vivax tubulin gamma chain, putative 0.0131 0.1357 0.4883
Echinococcus multilocularis Tubulin alpha 1 chain 0.0179 0.1936 0.1929
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Leishmania major beta tubulin 0.0249 0.2778 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0057 0.0462 0.0454
Onchocerca volvulus 0.005 0.0379 0.1319
Trichomonas vaginalis tubulin gamma chain, putative 0.0131 0.1357 0.4176
Loa Loa (eye worm) tubulin alpha chain 0.0179 0.1936 0.6872
Schistosoma mansoni serine/threonine protein kinase 0.0099 0.0968 0.2803
Echinococcus granulosus zinc finger protein 0.002 0.0024 0.004
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.0029 0.0125 0.0342
Loa Loa (eye worm) hypothetical protein 0.0025 0.0076 0.027
Schistosoma mansoni hypothetical protein 0.0043 0.0291 0.0825
Giardia lamblia Beta tubulin 0.0249 0.2778 0.9855
Onchocerca volvulus Serine\/threonine kinase homolog 0.0099 0.0968 0.3418
Schistosoma mansoni alpha tubulin 0.0179 0.1936 0.5629
Trichomonas vaginalis tubulin, putative 0.0249 0.2778 0.9846
Schistosoma mansoni kinase 0.005 0.0382 0.1093
Echinococcus granulosus beta tubulin 0.0249 0.2778 0.6875
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.01 0.0981 0.0974
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0076 0.0242
Schistosoma mansoni tubulin subunit delta 0.0057 0.0463 0.1328
Echinococcus multilocularis beta tubulin 0.0249 0.2778 0.2772
Echinococcus granulosus alpha tubulin 0.0179 0.1936 0.4784
Loa Loa (eye worm) hypothetical protein 0.003 0.0145 0.0514
Brugia malayi Tubulin alpha chain 0.0179 0.1936 0.6863
Trypanosoma brucei polo-like protein kinase 0.0099 0.0968 0.2181
Onchocerca volvulus 0.0025 0.0076 0.0242
Trichomonas vaginalis tubulin gamma chain, putative 0.0249 0.2778 0.9846
Brugia malayi mbt repeat family protein 0.005 0.0379 0.1319
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0192 0.2092 0.5171
Brugia malayi Cell division protein ftsZ 0.0057 0.0463 0.162
Brugia malayi Bromodomain containing protein 0.0033 0.0175 0.0593
Schistosoma mansoni netrin receptor unc5 0.0029 0.0125 0.0342
Loa Loa (eye worm) tubulin beta-1 chain 0.0249 0.2778 0.9863
Brugia malayi PHD-finger family protein 0.0026 0.0091 0.0296
Echinococcus multilocularis Ankyrin 0.0029 0.0125 0.0117
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0252 0.2817 1
Echinococcus granulosus tubulin epsilon chain 0.0131 0.1357 0.3348
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0002
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0252 0.2817 1
Plasmodium falciparum tubulin epsilon chain, putative 0.0131 0.1357 0.4883
Echinococcus granulosus acetylcholinesterase 0.007 0.0626 0.1533
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0354 0.0858
Onchocerca volvulus 0.0052 0.0401 0.1398
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Brugia malayi Protein kinase domain containing protein 0.0029 0.0129 0.0431
Brugia malayi Tubulin beta chain 0.0057 0.0463 0.162
Echinococcus multilocularis histone acetyltransferase MYST2 0.0057 0.0462 0.0454
Echinococcus multilocularis tubulin alpha chain 0.0179 0.1936 0.1929
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0252 0.2817 1
Brugia malayi Bromodomain containing protein 0.004 0.026 0.0897
Loa Loa (eye worm) hypothetical protein 0.007 0.0626 0.2222
Onchocerca volvulus Netrin receptor homolog 0.0029 0.0125 0.0417
Trichomonas vaginalis tubulin beta chain, putative 0.0249 0.2778 0.9846
Plasmodium vivax delta tubulin, putative 0.0057 0.0463 0.1665
Loa Loa (eye worm) acetylcholinesterase 1 0.007 0.0626 0.2222
Loa Loa (eye worm) hypothetical protein 0.0044 0.031 0.11
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.0536 0.1904
Trichomonas vaginalis conserved hypothetical protein 0.0057 0.0463 0.0611
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Loa Loa (eye worm) tubulin alpha chain 0.0179 0.1936 0.6872
Trichomonas vaginalis tubulin, putative 0.0057 0.0463 0.0611
Loa Loa (eye worm) hypothetical protein 0.0103 0.1018 0.3616
Echinococcus multilocularis polycomb protein SCMH1 0.005 0.0379 0.0371
Schistosoma mansoni hypothetical protein 0.0177 0.1913 0.5564
Mycobacterium ulcerans hypothetical protein 0.0025 0.0076 0.0268
Trypanosoma cruzi beta tubulin, putative 0.0249 0.2778 1
Brugia malayi tubulin alpha chain - mouse 0.0179 0.1936 0.6863
Schistosoma mansoni tubulin subunit alpha 0.0179 0.1936 0.5629
Leishmania major beta tubulin 0.0249 0.2778 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0076 0.0268
Schistosoma mansoni hypothetical protein 0.0177 0.1913 0.5564
Toxoplasma gondii beta-tubulin, putative 0.0249 0.2778 1
Schistosoma mansoni jumonji domain containing protein 0.0079 0.0734 0.2118
Plasmodium falciparum fructose-bisphosphate aldolase 0.0192 0.2092 0.7528
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0192 0.2092 0.5171
Schistosoma mansoni fructose 16-bisphosphate aldolase 0.0192 0.2092 0.6083
Trichomonas vaginalis tubulin, putative 0.0074 0.0671 0.1441
Loa Loa (eye worm) tubulin beta-2A chain 0.0249 0.2778 0.9863
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0105 0.1042 0.292
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0354 0.1231
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.005 0.0379 0.1319
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Trypanosoma brucei alpha tubulin 0.0179 0.1936 0.6361
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0252 0.2817 1
Loa Loa (eye worm) hypothetical protein 0.007 0.0626 0.2222
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0122 0.125 0.375
Brugia malayi Tubulin alpha chain 0.0057 0.0463 0.162
Echinococcus multilocularis Niemann Pick C1 protein 0.0147 0.1551 0.1544
Loa Loa (eye worm) PHD-finger family protein 0.003 0.0145 0.0514
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0252 0.2817 1
Leishmania major beta tubulin 0.0249 0.2778 1
Echinococcus granulosus netrin receptor unc 5 0.0029 0.0125 0.0291
Trichomonas vaginalis tubulin epsilon chain, putative 0.0057 0.0463 0.0611
Trichomonas vaginalis tubulin gamma chain, putative 0.0057 0.0463 0.0611
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Loa Loa (eye worm) hypothetical protein 0.004 0.0261 0.0927
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0099 0.0968 0.0961
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0192 0.2092 0.2085
Brugia malayi jmjC domain containing protein 0.01 0.0981 0.3464
Loa Loa (eye worm) alpha-tubulin 0.0179 0.1936 0.6872
Echinococcus multilocularis zinc finger protein 0.002 0.0024 0.0016
Leishmania major gamma-tubulin 0.0131 0.1357 0.474
Schistosoma mansoni hypothetical protein 0.0043 0.0291 0.0825
Schistosoma mansoni zinc finger protein 0.002 0.0024 0.0046
Echinococcus multilocularis Tubulin alpha 1 chain 0.0179 0.1936 0.1929
Brugia malayi Tubulin alpha-2 chain 0.0179 0.1936 0.6863
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0354 0.0858
Schistosoma mansoni hypothetical protein 0.003 0.0145 0.0399
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0029 0.0125 0.0445
Loa Loa (eye worm) BEN-1 protein 0.0249 0.2778 0.9863
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.005 0.0379 0.1082
Brugia malayi beta-tubulin, identical 0.0249 0.2778 0.9862
Loa Loa (eye worm) jmjC domain-containing protein 0.0039 0.0246 0.0874
Echinococcus multilocularis Tubulin alpha 1 chain 0.0179 0.1936 0.1929
Echinococcus multilocularis tubulin alpha 1C chain 0.0179 0.1936 0.1929
Loa Loa (eye worm) hypothetical protein 0.0045 0.0315 0.1118
Echinococcus multilocularis hypothetical protein 0.0179 0.1936 0.1929
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.0671 0.1441
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0125 0.0417
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0038 0.023 0.0222
Echinococcus granulosus tubulin alpha 3 chain 0.0179 0.1936 0.4784
Loa Loa (eye worm) alpha-tubulin 0.0179 0.1936 0.6872
Brugia malayi PHD-finger family protein 0.003 0.0145 0.0487
Schistosoma mansoni tubulin subunit beta 0.0057 0.0463 0.1328
Plasmodium vivax tubulin alpha chain, putative 0.0179 0.1936 0.6967
Toxoplasma gondii fructose-bisphosphate aldolase, putative 0.0192 0.2092 0.7393
Leishmania major delta tubulin, putative 0.0057 0.0463 0.1432
Schistosoma mansoni fructose 16-bisphosphate aldolase 0.0192 0.2092 0.6083
Echinococcus granulosus tubulin beta 1 chain 0.0249 0.2778 0.6875
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Echinococcus granulosus PHD finger protein rhinoceros 0.003 0.0145 0.0339
Echinococcus granulosus tubulin alpha chain 0.0179 0.1936 0.4784
Echinococcus granulosus Protein patched homolog 1 0.0044 0.031 0.0749
Mycobacterium leprae cell division protein FtsZ 0.0057 0.0463 1
Echinococcus multilocularis tumor necrosis factor receptor superfamily 0.0044 0.0308 0.0301
Echinococcus multilocularis SAM and MBT domain containing protein 0.005 0.0379 0.0371
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Loa Loa (eye worm) hypothetical protein 0.0025 0.0076 0.027
Brugia malayi CHE-14 protein 0.0044 0.031 0.1074
Echinococcus granulosus Niemann Pick C1 protein 0.0103 0.1018 0.2508
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0057 0.0462 0.1126
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0076 0.0268
Schistosoma mansoni alpha tubulin 0.0179 0.1936 0.5629
Giardia lamblia Beta tubulin 0.0249 0.2778 0.9855
Brugia malayi Carboxylesterase family protein 0.007 0.0626 0.22
Echinococcus granulosus tubulin beta 4A class IVa 0.0249 0.2778 0.6875
Echinococcus granulosus peroxisome assembly protein 26 0.0179 0.1936 0.4784
Schistosoma mansoni lipoxygenase 0.0115 0.1158 0.3358
Schistosoma mansoni hypothetical protein 0.0029 0.0125 0.0342
Echinococcus multilocularis tubulin alpha chain 0.0179 0.1936 0.1929
Leishmania major beta tubulin 0.0249 0.2778 1
Entamoeba histolytica tubulin family protein 0.0249 0.2778 0.9859
Leishmania major beta tubulin 0.0249 0.2778 1
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.0008 0.0027
Brugia malayi Carboxylesterase family protein 0.007 0.0626 0.22
Trichomonas vaginalis tubulin, putative 0.0074 0.0671 0.1441
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.0671 0.1441
Trypanosoma cruzi epsilon tubulin, putative 0.0131 0.1357 0.3861
Echinococcus granulosus tubulin alpha 1C chain 0.0179 0.1936 0.4784
Loa Loa (eye worm) hypothetical protein 0.0043 0.0291 0.1033
Mycobacterium ulcerans cell division protein FtsZ 0.0057 0.0463 0.1642
Echinococcus multilocularis sterol regulatory element binding protein 0.0044 0.031 0.0302
Schistosoma mansoni sex comb on midleg homolog 0.005 0.0379 0.1082
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Trypanosoma brucei fructose-bisphosphate aldolase, glycosomal, putative 0.0192 0.2092 0.7034
Trypanosoma brucei beta tubulin 0.0249 0.2778 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.2778 0.2772
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0131 0.1357 0.4603
Echinococcus multilocularis fructose bisphosphate aldolase class I 0.0192 0.2092 0.2085
Echinococcus multilocularis acetylcholinesterase 0.007 0.0626 0.0618
Plasmodium vivax tubulin beta chain, putative 0.0249 0.2778 1
Echinococcus granulosus tubulin alpha 1C chain 0.0179 0.1936 0.4784
Leishmania major beta tubulin 0.0249 0.2778 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0002
Entamoeba histolytica serine/threonine protein kinase, putative 0.0099 0.0968 0.3255
Echinococcus granulosus Tubulin alpha 1 chain 0.0179 0.1936 0.4784
Giardia lamblia Kinase, PLK 0.0099 0.0968 0.3081
Schistosoma mansoni hypothetical protein 0.0043 0.0291 0.0825
Loa Loa (eye worm) tubulin beta-4 chain 0.0249 0.2778 0.9863
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0252 0.2817 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0249 0.2778 0.9846
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0057 0.0463 0.5
Leishmania major beta tubulin 0.0249 0.2778 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.043 0.1526
Trypanosoma brucei beta tubulin 0.0249 0.2778 1
Echinococcus granulosus Ankyrin 0.0029 0.0125 0.0291
Leishmania major beta tubulin 0.0249 0.2778 1
Brugia malayi tubulin alpha-2 chain 0.0179 0.1936 0.6863
Brugia malayi Death domain containing protein 0.0029 0.0125 0.0417
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0057 0.0463 0.0611
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0115 0.1158 0.2855
Schistosoma mansoni hypothetical protein 0.0043 0.0291 0.0825
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.0008 0.0027
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0122 0.125 0.4437
Plasmodium falciparum tubulin delta chain, putative 0.0057 0.0463 0.1665
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Echinococcus multilocularis tubulin alpha chain 0.0179 0.1936 0.1929
Echinococcus granulosus death domain containing protein 0.0029 0.0125 0.0291
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Echinococcus granulosus fructose 16 bisphosphate aldolase 0.0192 0.2092 0.5171
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0076 0.0268
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Loa Loa (eye worm) fructose-bisphosphate aldolase 2 0.0192 0.2092 0.7425
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0057 0.0463 0.1209
Brugia malayi serine/threonine-protein kinase plk-2 0.0099 0.0968 0.3418
Plasmodium falciparum phd finger protein, putative 0.003 0.0145 0.0519
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.053 0.1295
Entamoeba histolytica tubulin alpha-1 chain 0.0179 0.1936 0.6785
Echinococcus multilocularis acetylcholinesterase 0.007 0.0626 0.0618
Brugia malayi Tubulin gamma chain 0.0131 0.1357 0.4802
Loa Loa (eye worm) mbt repeat family protein 0.005 0.0379 0.1344
Plasmodium vivax tubulin epsilon chain, putative 0.0131 0.1357 0.4883
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Plasmodium falciparum alpha tubulin 2 0.0179 0.1936 0.6967
Echinococcus multilocularis tubulin alpha chain 0.0179 0.1936 0.1929
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.007 0.0626 0.1804
Echinococcus multilocularis beta tubulin 0.0249 0.2778 0.2772
Echinococcus granulosus beta tubulin 0.0249 0.2778 0.6875
Brugia malayi mbt repeat family protein 0.005 0.0379 0.1319
Echinococcus multilocularis tubulin alpha 3 chain 0.0179 0.1936 0.1929
Loa Loa (eye worm) hypothetical protein 0.0019 0.0008 0.0029
Trypanosoma brucei beta tubulin 0.0131 0.1357 0.3861
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Loa Loa (eye worm) tubulin alpha-3 chain 0.0105 0.1042 0.3699
Brugia malayi Uncoordinated protein 44 0.0029 0.0125 0.0417
Trypanosoma cruzi tubulin gamma chain 0.0131 0.1357 0.3861
Trichomonas vaginalis tubulin gamma chain, putative 0.0131 0.1357 0.4176
Giardia lamblia Delta tubulin 0.0057 0.0463 0.1191
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0115 0.1158 0.1151
Echinococcus multilocularis tubulin subunit TubB 0.0179 0.1936 0.1929
Brugia malayi fructose-bisphosphate aldolase 2 0.0192 0.2092 0.7418
Echinococcus granulosus carboxylesterase 5A 0.007 0.0626 0.1533
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0249 0.2778 0.2772
Loa Loa (eye worm) hypothetical protein 0.0122 0.125 0.4437
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.2778 0.2772
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Entamoeba histolytica tubulin alpha chain, putative 0.0179 0.1936 0.6785
Schistosoma mansoni hypothetical protein 0.0022 0.0037 0.0085
Echinococcus granulosus lysine specific demethylase 5A 0.0039 0.0246 0.0591
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.0037 0.0133
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0019 0.0001 0.5
Trypanosoma brucei tubulin gamma chain 0.0131 0.1357 0.3861
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0192 0.2092 0.7034
Echinococcus multilocularis tubulin alpha 3 chain 0.0179 0.1936 0.1929
Loa Loa (eye worm) hypothetical protein 0.005 0.0379 0.1344
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0076 0.0268
Brugia malayi alpha-tubulin 0.0179 0.1936 0.6863
Loa Loa (eye worm) tubulin alpha 2 0.0122 0.125 0.4437
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0038 0.023 0.0551
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0057 0.0462 0.1615
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0076 0.0268
Loa Loa (eye worm) beta-tubulin 0.0249 0.2778 0.9863
Toxoplasma gondii beta tubulin 0.0249 0.2778 1
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0192 0.2092 0.7034
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0367 0.0227
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0354 0.1257
Loa Loa (eye worm) tubulin alpha 2 0.0048 0.0356 0.1265
Echinococcus granulosus tubulin alpha chain 0.0179 0.1936 0.4784
Schistosoma mansoni tubulin subunit gamma 0.0131 0.1357 0.3938
Entamoeba histolytica tubulin family protein 0.0249 0.2778 0.9859
Loa Loa (eye worm) tubulin gamma chain 0.0131 0.1357 0.4817
Brugia malayi Tubulin beta chain 0.0074 0.0671 0.236
Mycobacterium tuberculosis Cell division protein FtsZ 0.0057 0.0463 0.1642
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.0671 0.1441
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Echinococcus granulosus Tubulin alpha 1 chain 0.0179 0.1936 0.4784
Echinococcus multilocularis tubulin alpha chain 0.0179 0.1936 0.1929
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Echinococcus multilocularis TNFR CD27 30 40 95 cysteine rich region 0.0044 0.0308 0.0301
Echinococcus granulosus tubulin alpha chain 0.0179 0.1936 0.4784
Echinococcus granulosus TNFR CD27 30 40 95 cysteine rich region 0.0044 0.0308 0.0745
Leishmania major beta tubulin 0.0249 0.2778 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0197 0.2147 0.5309
Leishmania major beta tubulin 0.0249 0.2778 1
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0252 0.2817 1
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.0252 0.2817 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0076 0.0268
Toxoplasma gondii alpha-tubulin I, putative 0.0179 0.1936 0.6801
Toxoplasma gondii fructose-1,6-bisphosphate aldolase 0.0192 0.2092 0.7393
Echinococcus multilocularis peroxisome assembly protein 26 0.0179 0.1936 0.1929
Loa Loa (eye worm) hypothetical protein 0.0029 0.0125 0.0445
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.053 0.0522
Trichomonas vaginalis tubulin beta chain, putative 0.0179 0.1936 0.6486
Plasmodium falciparum alpha tubulin 1 0.0179 0.1936 0.6967
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0354 0.101
Trypanosoma cruzi epsilon tubulin, putative 0.0131 0.1357 0.3861
Brugia malayi Niemann-Pick C1 protein precursor 0.0103 0.1018 0.3597
Leishmania major epsilon tubulin, putative 0.0131 0.1357 0.474
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0354 0.0346
Trypanosoma brucei alpha tubulin 0.0179 0.1936 0.6361
Echinococcus granulosus fructose bisphosphate aldolase class I 0.0192 0.2092 0.5171
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.01 0.0981 0.2415
Echinococcus granulosus tubulin alpha chain 0.0179 0.1936 0.4784
Trichomonas vaginalis tubulin epsilon chain, putative 0.0249 0.2778 0.9846
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0105 0.1038 0.3006
Trypanosoma cruzi polo-like protein kinase, putative 0.0099 0.0968 0.2181
Loa Loa (eye worm) fructose-bisphosphate aldolase 1 0.0192 0.2092 0.7425
Giardia lamblia Gamma tubulin 0.0131 0.1357 0.4536
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.2778 0.6875
Echinococcus multilocularis protein dispatched 1 0.005 0.0385 0.0377
Echinococcus multilocularis jumonji domain containing protein 0.0042 0.0289 0.0281
Loa Loa (eye worm) doublecortin family protein 0.0019 0.0008 0.0029
Leishmania major beta tubulin 0.0249 0.2778 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0246 0.0695
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0179 0.1936 0.6486
Schistosoma mansoni tubulin subunit alpha 0.0179 0.1936 0.5629
Giardia lamblia Alpha-tubulin 0.0179 0.1936 0.6703
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Echinococcus granulosus sterol regulatory element binding protein 0.0044 0.031 0.0749
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.2778 0.6875
Schistosoma mansoni patched 1 0.0044 0.031 0.0881
Echinococcus granulosus tumor protein p63 0.0353 0.4037 1
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Echinococcus granulosus tubulin gamma 1 chain 0.0131 0.1357 0.3348
Loa Loa (eye worm) tubulin beta chain 0.0249 0.2778 0.9863
Trypanosoma brucei alpha tubulin 0.0179 0.1936 0.6361
Loa Loa (eye worm) carboxylesterase 0.007 0.0626 0.2222
Loa Loa (eye worm) MBCTL1 0.0057 0.0462 0.164
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Loa Loa (eye worm) hypothetical protein 0.0029 0.0125 0.0445
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.2778 0.6875
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0252 0.2817 1
Leishmania major beta tubulin 0.0249 0.2778 1
Giardia lamblia Epsilon tubulin 0.0057 0.0463 0.1191
Echinococcus multilocularis tubulin alpha 0.0131 0.1357 0.135
Brugia malayi Bromodomain containing protein 0.0078 0.0723 0.2544
Brugia malayi fructose-bisphosphate aldolase 1 0.0192 0.2092 0.7418
Toxoplasma gondii alpha tubulin TUBA1 0.0179 0.1936 0.6801
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0099 0.0968 0.2383
Schistosoma mansoni myelin transcription factor 1 myt1 0.0057 0.0462 0.1325
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Schistosoma mansoni tubulin subunit epsilon 0.0131 0.1357 0.3938
Loa Loa (eye worm) hypothetical protein 0.0019 0.0008 0.0029
Echinococcus granulosus tubulin alpha 0.0131 0.1357 0.3348
Trichomonas vaginalis conserved hypothetical protein 0.0057 0.0463 0.0611
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0076 0.0242
Trichomonas vaginalis tubulin epsilon chain, putative 0.0179 0.1936 0.6486
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0099 0.0968 0.3301
Loa Loa (eye worm) hypothetical protein 0.0052 0.0407 0.1446
Echinococcus multilocularis geminin 0.0177 0.1913 0.1907
Schistosoma mansoni hypothetical protein 0.0303 0.3433 1
Echinococcus multilocularis tubulin delta chain 0.0057 0.0463 0.0455
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.2778 0.2772
Trichomonas vaginalis tubulin alpha chain, putative 0.0249 0.2778 0.9846
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0099 0.0968 0.3437
Echinococcus multilocularis expressed conserved protein 0.0097 0.0943 0.0936
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0354 0.101
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Echinococcus granulosus expressed conserved protein 0.0097 0.0943 0.2321
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0354 0.101
Loa Loa (eye worm) BEN-1 protein 0.0249 0.2778 0.9863
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.2778 0.6875
Trypanosoma brucei epsilon tubulin 0.0131 0.1357 0.3861
Echinococcus granulosus acetylcholinesterase 0.007 0.0626 0.1533
Schistosoma mansoni tumor necrosis factor receptor related 0.0044 0.0308 0.0877
Echinococcus multilocularis tubulin gamma 1 chain 0.0131 0.1357 0.135
Loa Loa (eye worm) hypothetical protein 0.0052 0.0401 0.1423
Leishmania major zeta tubulin, putative 0.0057 0.0463 0.1432
Trichomonas vaginalis tubulin epsilon chain, putative 0.0179 0.1936 0.6486
Plasmodium falciparum tubulin gamma chain 0.0131 0.1357 0.4883
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0246 0.0695
Leishmania major beta tubulin 0.0249 0.2778 1
Onchocerca volvulus 0.0074 0.0671 0.236
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.0029 0.0125 0.0291
Leishmania major fructose-1,6-bisphosphate aldolase 0.0192 0.2092 0.7459
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0002
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0061 0.0156
Leishmania major beta tubulin 0.0249 0.2778 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0061 0.0053
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0076 0.0268
Brugia malayi AMP-binding enzyme family protein 0.0025 0.0076 0.0242
Brugia malayi jmjC domain containing protein 0.0039 0.0246 0.0848
Loa Loa (eye worm) tubulin beta chain 0.0057 0.0463 0.1644
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0044 0.031 0.11
Echinococcus multilocularis protein patched 0.0044 0.031 0.0302
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0061 0.0132
Echinococcus granulosus tumor necrosis factor receptor superfamily 0.0044 0.0308 0.0745
Toxoplasma gondii fructose-1,6-bisphosphate aldolase 0.0192 0.2092 0.7393
Trichomonas vaginalis CAMK family protein kinase 0.0049 0.0367 0.0227
Echinococcus granulosus geminin 0.0177 0.1913 0.4729
Leishmania major beta tubulin 0.0249 0.2778 1
Entamoeba histolytica tubulin gamma chain 0.0131 0.1357 0.4673
Echinococcus multilocularis PHD finger protein rhinoceros 0.003 0.0145 0.0137
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0252 0.2817 1
Brugia malayi Tubulin beta-1 chain 0.0249 0.2778 0.9862
Plasmodium vivax hypothetical protein, conserved 0.003 0.0145 0.0519
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.2778 0.6875
Loa Loa (eye worm) hypothetical protein 0.0057 0.0462 0.164
Treponema pallidum cell division protein FtsZ 0.0057 0.0463 0.5
Giardia lamblia Alpha-tubulin 0.0179 0.1936 0.6703
Plasmodium falciparum tubulin beta chain 0.0249 0.2778 1
Leishmania major beta tubulin 0.0249 0.2778 1
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0192 0.2092 0.7034
Echinococcus multilocularis tubulin alpha 1C chain 0.0179 0.1936 0.1929
Onchocerca volvulus Alhambra homolog 0.003 0.0145 0.0487
Echinococcus multilocularis carboxylesterase 5A 0.007 0.0626 0.0618
Trypanosoma cruzi alpha tubulin, putative 0.0179 0.1936 0.6361
Echinococcus multilocularis tubulin epsilon chain 0.0131 0.1357 0.135
Schistosoma mansoni cellular tumor antigen P53 0.0052 0.0401 0.1146
Trypanosoma brucei alpha tubulin, putative 0.0074 0.0671 0.0898
Leishmania major alpha tubulin 0.0179 0.1936 0.6882
Trypanosoma brucei epsilon tubulin 0.0131 0.1357 0.3861
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0252 0.2817 1
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0252 0.2817 1
Echinococcus granulosus histone acetyltransferase MYST2 0.0057 0.0462 0.1126
Echinococcus granulosus tubulin delta chain 0.0057 0.0463 0.1129
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0197 0.2147 0.2141
Trypanosoma brucei epsilon tubulin 0.0131 0.1357 0.3861
Echinococcus granulosus peregrin 0.0033 0.0175 0.0413
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0222 0.0214
Leishmania major beta tubulin 0.0249 0.2778 1
Schistosoma mansoni alpha tubulin 0.0179 0.1936 0.5629
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.003 0.0145 0.0399
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0002
Plasmodium vivax tubulin alpha chain, putative 0.0179 0.1936 0.6967
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Echinococcus granulosus SAM and MBT domain containing protein 0.005 0.0379 0.092
Echinococcus multilocularis tumor protein p63 0.0353 0.4037 0.4032
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0074 0.0671 0.1441
Echinococcus multilocularis Niemann Pick C1 protein 0.0103 0.1018 0.1011
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Trypanosoma brucei beta tubulin 0.0249 0.2778 1
Loa Loa (eye worm) hypothetical protein 0.0074 0.0669 0.2375
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0057 0.0463 0.1209
Brugia malayi Tubulin alpha-2 chain 0.0179 0.1936 0.6863
Giardia lamblia Beta tubulin 0.0249 0.2778 0.9855
Schistosoma mansoni tubulin subunit alpha 0.0057 0.0463 0.1328
Schistosoma mansoni sex comb on midleg homolog 0.005 0.0379 0.1082
Trypanosoma brucei alpha tubulin 0.0179 0.1936 0.6361
Echinococcus granulosus tubulin alpha 3 chain 0.0179 0.1936 0.4784
Schistosoma mansoni ankyrin 23/unc44 0.0029 0.0125 0.0342
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0192 0.2092 0.2085
Schistosoma mansoni bromodomain containing protein 0.0066 0.0575 0.1655
Loa Loa (eye worm) hypothetical protein 0.0025 0.0076 0.027
Onchocerca volvulus 0.0252 0.2817 1
Echinococcus granulosus tubulin subunit TubB 0.0179 0.1936 0.4784
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.0103 0.1018 0.3438
Echinococcus granulosus tubulin subunit beta 0.0249 0.2778 0.6875
Plasmodium vivax fructose 1,6-bisphosphate aldolase, putative 0.0192 0.2092 0.7528
Echinococcus multilocularis fructose 1,6 bisphosphate aldolase 0.0192 0.2092 0.2085
Echinococcus multilocularis tubulin subunit beta 0.0249 0.2778 0.2772
Trypanosoma cruzi fructose-bisphosphate aldolase, glycosomal, putative 0.0192 0.2092 0.7034
Echinococcus granulosus polycomb protein SCMH1 0.005 0.0379 0.092
Trichomonas vaginalis CAMK family protein kinase 0.0099 0.0968 0.2626
Loa Loa (eye worm) hypothetical protein 0.0019 0.0001 0.0002
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Schistosoma mansoni tubulin subunit beta 0.0249 0.2778 0.8088
Schistosoma mansoni tubulin subunit alpha 0.0179 0.1936 0.5629

Activities

Activity type Activity value Assay description Source Reference
logP (ADMET) = -2.3 Partition coefficient (logP) ChEMBL. 11784151

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.