Detailed information for compound 288966

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 550.904 | Formula: C36H62N4
  • H donors: 4 H acceptors: 0 LogP: 7.59 Rotable bonds: 27
    Rule of 5 violations (Lipinski): 2
  • SMILES: Cc1ccccc1CNCCCCCCNCCCCCCCCNCCCCCCNCc1ccccc1C
  • InChi: 1S/C36H62N4/c1-33-21-11-13-23-35(33)31-39-29-19-9-7-17-27-37-25-15-5-3-4-6-16-26-38-28-18-8-10-20-30-40-32-36-24-14-12-22-34(36)2/h11-14,21-24,37-40H,3-10,15-20,25-32H2,1-2H3
  • InChiKey: LJAHWUCLDQXGRN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cholinergic receptor, muscarinic 2 Starlite/ChEMBL References
Cavia porcellus Muscarinic acetylcholine receptor M3 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133264 All targets in OG5_133264
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_133264 All targets in OG5_133264
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Glycoprotein hormone beta 5 homolog Muscarinic acetylcholine receptor M3   587 aa 506 aa 34.6 %
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor Muscarinic acetylcholine receptor M3   587 aa 504 aa 26.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.3086 0.4823
Mycobacterium tuberculosis Probable isocitrate lyase AceAa [first part] (isocitrase) (isocitratase) (Icl) 0.0702 1 1
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Plasmodium falciparum tubulin gamma chain 0.0151 0.1581 0.334
Echinococcus granulosus tubulin alpha chain 0.0226 0.2731 0.4212
Plasmodium falciparum DNA gyrase subunit A 0.032 0.4174 1
Leishmania major beta tubulin 0.0249 0.3086 1
Toxoplasma gondii alpha tubulin TUBA1 0.0226 0.2731 0.6293
Echinococcus multilocularis peroxisome assembly protein 26 0.0226 0.2731 0.4212
Mycobacterium tuberculosis Probable isocitrate lyase AceAb [second part] (isocitrase) (isocitratase) (Icl) 0.0702 1 1
Plasmodium vivax tubulin beta chain, putative 0.0249 0.3086 0.7206
Echinococcus granulosus tubulin alpha 0.0151 0.1581 0.2235
Brugia malayi Tubulin alpha chain 0.0065 0.0281 0.0461
Echinococcus multilocularis tubulin alpha 1C chain 0.0226 0.2731 0.4212
Giardia lamblia Alpha-tubulin 0.0226 0.2731 0.8733
Trichomonas vaginalis tubulin epsilon chain, putative 0.0226 0.2731 0.8733
Brugia malayi Tubulin alpha-2 chain 0.0226 0.2731 0.4479
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0294 0.0023
Trichomonas vaginalis tubulin epsilon chain, putative 0.0249 0.3086 1
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0151 0.1581 0.334
Echinococcus multilocularis tubulin alpha chain 0.0226 0.2731 0.4212
Loa Loa (eye worm) RNA binding protein 0.0066 0.0294 0.0325
Echinococcus multilocularis Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Loa Loa (eye worm) hypothetical protein 0.0073 0.0393 0.0467
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Echinococcus multilocularis hypothetical protein 0.0226 0.2731 0.4212
Trichomonas vaginalis tubulin epsilon chain, putative 0.0226 0.2731 0.8733
Trichomonas vaginalis tubulin gamma chain, putative 0.0249 0.3086 1
Loa Loa (eye worm) tubulin alpha-3 chain 0.0141 0.1431 0.1958
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0153 0.1614 0.1372
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0141 0.1431 0.4098
Brugia malayi RNA binding protein 0.0066 0.0294 0.0483
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus multilocularis tubulin alpha 1C chain 0.0226 0.2731 0.4212
Loa Loa (eye worm) BEN-1 protein 0.0249 0.3086 0.4338
Trichomonas vaginalis tubulin alpha chain, putative 0.0249 0.3086 1
Trypanosoma brucei beta tubulin 0.0151 0.1581 0.4635
Giardia lamblia Gamma tubulin 0.0151 0.1581 0.4635
Trypanosoma cruzi epsilon tubulin, putative 0.0151 0.1581 0.4635
Schistosoma mansoni alpha tubulin 0.0226 0.2731 0.4212
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0294 0.0325
Loa Loa (eye worm) tubulin beta chain 0.0249 0.3086 0.4338
Brugia malayi tubulin alpha-2 chain 0.0226 0.2731 0.4479
Echinococcus granulosus tubulin alpha 3 chain 0.0226 0.2731 0.4212
Trypanosoma brucei epsilon tubulin 0.0151 0.1581 0.4635
Schistosoma mansoni alpha tubulin 0.0226 0.2731 0.4212
Loa Loa (eye worm) tubulin beta-4 chain 0.0249 0.3086 0.4338
Echinococcus granulosus tubulin beta 4A class IVa 0.0249 0.3086 0.4823
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0294 0.0023
Trypanosoma brucei epsilon tubulin 0.0151 0.1581 0.4635
Plasmodium falciparum alpha tubulin 1 0.0226 0.2731 0.6293
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0447 0.6097 1
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0294 0.0483
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0136 0.1364 0.1862
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.3086 0.4823
Mycobacterium tuberculosis DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.032 0.4174 0.4005
Echinococcus multilocularis tubulin alpha chain 0.0226 0.2731 0.4212
Brugia malayi Cell division protein ftsZ 0.0065 0.0281 0.0461
Trichomonas vaginalis tubulin alpha chain, putative 0.0085 0.0584 0.1078
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Echinococcus granulosus tubulin subunit TubB 0.0226 0.2731 0.4212
Plasmodium vivax DNA gyrase subunit A, putative 0.032 0.4174 1
Loa Loa (eye worm) tubulin gamma chain 0.0151 0.1581 0.2175
Loa Loa (eye worm) tubulin alpha 2 0.0075 0.0433 0.0524
Loa Loa (eye worm) hypothetical protein 0.0093 0.0705 0.0916
Echinococcus granulosus tubulin alpha 3 chain 0.0226 0.2731 0.4212
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0294 0.0023
Loa Loa (eye worm) alpha-tubulin 0.0226 0.2731 0.3827
Plasmodium falciparum ataxin-2 like protein, putative 0.0073 0.0393 0.0289
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Leishmania major beta tubulin 0.0249 0.3086 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0234 0.2847 0.3994
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Plasmodium falciparum tubulin beta chain 0.0249 0.3086 0.7206
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Echinococcus granulosus tar DNA binding protein 0.0066 0.0294 0.0023
Trypanosoma cruzi PAB1-binding protein , putative 0.0073 0.0393 0.0401
Brugia malayi alpha-tubulin 0.0226 0.2731 0.4479
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus granulosus tubulin gamma 1 chain 0.0151 0.1581 0.2235
Entamoeba histolytica tubulin family protein 0.0249 0.3086 1
Echinococcus granulosus beta tubulin 0.0249 0.3086 0.4823
Echinococcus granulosus Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Giardia lamblia Alpha-tubulin 0.0226 0.2731 0.8733
Echinococcus granulosus tubulin alpha chain 0.0226 0.2731 0.4212
Brugia malayi Tubulin alpha-2 chain 0.0226 0.2731 0.4479
Trypanosoma brucei beta tubulin 0.0249 0.3086 1
Echinococcus granulosus tubulin alpha chain 0.0226 0.2731 0.4212
Echinococcus multilocularis tubulin epsilon chain 0.0151 0.1581 0.2235
Onchocerca volvulus 0.0419 0.5681 1
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.3086 0.4823
Loa Loa (eye worm) hypothetical protein 0.0226 0.2731 0.3827
Trichomonas vaginalis tubulin alpha chain, putative 0.0151 0.1581 0.4635
Brugia malayi hypothetical protein 0.0073 0.0393 0.0645
Plasmodium vivax ataxin-2 like protein, putative 0.0073 0.0393 0.0289
Leishmania major beta tubulin 0.0249 0.3086 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0136 0.1364 0.2237
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0294 0.0023
Trypanosoma brucei beta tubulin 0.0249 0.3086 1
Brugia malayi Tubulin beta-1 chain 0.0249 0.3086 0.5062
Brugia malayi TAR-binding protein 0.0066 0.0294 0.0483
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus granulosus beta tubulin 0.0249 0.3086 0.4823
Plasmodium falciparum alpha tubulin 2 0.0226 0.2731 0.6293
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.3086 0.4823
Entamoeba histolytica tubulin family protein 0.0249 0.3086 1
Brugia malayi Tubulin beta chain 0.0065 0.0281 0.0461
Trichomonas vaginalis tubulin gamma chain, putative 0.0151 0.1581 0.4635
Trypanosoma brucei PAB1-binding protein , putative 0.0073 0.0393 0.0401
Brugia malayi hypothetical protein 0.0419 0.5681 0.9318
Echinococcus multilocularis tubulin beta 1 chain 0.0249 0.3086 0.4823
Trypanosoma brucei alpha tubulin, putative 0.0085 0.0584 0.1078
Leishmania major beta tubulin 0.0249 0.3086 1
Loa Loa (eye worm) tubulin alpha chain 0.0226 0.2731 0.3827
Mycobacterium tuberculosis Isocitrate lyase Icl (isocitrase) (isocitratase) 0.0702 1 1
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus granulosus tubulin epsilon chain 0.0151 0.1581 0.2235
Plasmodium falciparum ataxin-2 like protein, putative 0.0073 0.0393 0.0289
Leishmania major beta tubulin 0.0249 0.3086 1
Schistosoma mansoni tubulin subunit gamma 0.0151 0.1581 0.2235
Brugia malayi Tubulin gamma chain 0.0151 0.1581 0.2593
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.3086 0.4823
Brugia malayi tubulin alpha chain - mouse 0.0226 0.2731 0.4479
Schistosoma mansoni tubulin subunit alpha 0.0226 0.2731 0.4212
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Trypanosoma brucei tubulin gamma chain 0.0151 0.1581 0.4635
Loa Loa (eye worm) tubulin beta chain 0.0065 0.0281 0.0306
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0226 0.2731 0.8733
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.3086 0.4823
Mycobacterium ulcerans isocitrate lyase Icl 0.0702 1 1
Trypanosoma cruzi alpha tubulin, putative 0.0226 0.2731 0.8733
Plasmodium vivax tubulin alpha chain, putative 0.0226 0.2731 0.6293
Leishmania major gamma-tubulin 0.0151 0.1581 0.4635
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Trypanosoma brucei alpha tubulin 0.0226 0.2731 0.8733
Echinococcus multilocularis tubulin alpha 0.0151 0.1581 0.2235
Brugia malayi beta-tubulin, identical 0.0249 0.3086 0.5062
Trichomonas vaginalis tubulin, putative 0.0085 0.0584 0.1078
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0161 0.1733 0.5176
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Toxoplasma gondii beta-tubulin, putative 0.0249 0.3086 0.7206
Schistosoma mansoni hypothetical protein 0.0311 0.4027 0.6441
Toxoplasma gondii DNA gyrase/topoisomerase IV, A subunit domain-containing protein 0.032 0.4174 1
Loa Loa (eye worm) tubulin alpha 2 0.0161 0.1733 0.2393
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.3086 0.4823
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus granulosus tubulin beta 1 chain 0.0249 0.3086 0.4823
Schistosoma mansoni tubulin subunit alpha 0.0226 0.2731 0.4212
Loa Loa (eye worm) tubulin alpha-2 chain 0.0226 0.2731 0.3827
Trypanosoma brucei beta tubulin 0.0249 0.3086 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0249 0.3086 0.4823
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Toxoplasma gondii beta-1 tubulin, putative 0.0249 0.3086 0.7206
Trichomonas vaginalis tubulin, putative 0.0085 0.0584 0.1078
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0447 0.6097 1
Trypanosoma brucei alpha tubulin 0.0226 0.2731 0.8733
Mycobacterium ulcerans isocitrate lyase AceAb 0.0702 1 1
Trypanosoma brucei alpha tubulin 0.0226 0.2731 0.8733
Giardia lamblia Beta tubulin 0.0249 0.3086 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0073 0.0393 0.0401
Loa Loa (eye worm) hypothetical protein 0.0507 0.7024 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0249 0.3086 0.4823
Echinococcus multilocularis tubulin subunit beta 0.0249 0.3086 0.4823
Trypanosoma brucei alpha tubulin 0.0226 0.2731 0.8733
Leishmania major hypothetical protein, conserved 0.0073 0.0393 0.0401
Toxoplasma gondii alpha-tubulin I, putative 0.0226 0.2731 0.6293
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0294 0.0023
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Toxoplasma gondii beta tubulin 0.0249 0.3086 0.7206
Loa Loa (eye worm) hypothetical protein 0.0141 0.1431 0.1958
Echinococcus granulosus tubulin alpha chain 0.0226 0.2731 0.4212
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Brugia malayi latrophilin 2 splice variant baaae 0.0093 0.0705 0.1157
Schistosoma mansoni hypothetical protein 0.0093 0.0705 0.073
Brugia malayi Tubulin beta chain 0.0085 0.0584 0.0957
Echinococcus multilocularis tubulin alpha 3 chain 0.0226 0.2731 0.4212
Loa Loa (eye worm) alpha-tubulin 0.0226 0.2731 0.3827
Trypanosoma brucei epsilon tubulin 0.0151 0.1581 0.4635
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Mycobacterium leprae Isocitrate lyase 0.0329 0.4307 0.4142
Leishmania major beta tubulin 0.0249 0.3086 1
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.3086 0.4823
Trypanosoma cruzi epsilon tubulin, putative 0.0151 0.1581 0.4635
Echinococcus multilocularis Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Schistosoma mansoni hypothetical protein 0.0311 0.4027 0.6441
Echinococcus multilocularis geminin 0.0311 0.4027 0.6441
Leishmania major beta tubulin 0.0249 0.3086 1
Leishmania major beta tubulin 0.0249 0.3086 1
Mycobacterium ulcerans DNA gyrase subunit A 0.032 0.4174 0.4005
Toxoplasma gondii LsmAD domain-containing protein 0.0073 0.0393 0.0289
Echinococcus granulosus peroxisome assembly protein 26 0.0226 0.2731 0.4212
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0447 0.6097 0.8667
Loa Loa (eye worm) tubulin beta-1 chain 0.0249 0.3086 0.4338
Trichomonas vaginalis tubulin, putative 0.0249 0.3086 1
Echinococcus granulosus tubulin alpha 1C chain 0.0226 0.2731 0.4212
Entamoeba histolytica tubulin alpha-1 chain 0.0226 0.2731 0.7638
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0447 0.6097 1
Trichomonas vaginalis tubulin beta chain, putative 0.0249 0.3086 1
Trichomonas vaginalis tubulin beta chain, putative 0.0085 0.0584 0.1078
Schistosoma mansoni alpha tubulin 0.0226 0.2731 0.4212
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0294 0.0325
Giardia lamblia Beta tubulin 0.0249 0.3086 1
Trypanosoma brucei beta tubulin 0.0249 0.3086 1
Loa Loa (eye worm) tubulin alpha chain 0.0226 0.2731 0.3827
Wolbachia endosymbiont of Brugia malayi DNA gyrase subunit A 0.032 0.4174 1
Echinococcus multilocularis tubulin gamma 1 chain 0.0151 0.1581 0.2235
Brugia malayi follicle stimulating hormone receptor 0.0234 0.2847 0.4669
Echinococcus multilocularis tubulin alpha chain 0.0226 0.2731 0.4212
Trichomonas vaginalis tubulin alpha chain, putative 0.0085 0.0584 0.1078
Echinococcus multilocularis tubulin subunit TubB 0.0226 0.2731 0.4212
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0447 0.6097 1
Schistosoma mansoni tubulin subunit alpha 0.0226 0.2731 0.4212
Leishmania major alpha tubulin 0.0226 0.2731 0.8733
Echinococcus multilocularis beta tubulin 0.0249 0.3086 0.4823
Echinococcus multilocularis tubulin alpha chain 0.0226 0.2731 0.4212
Echinococcus multilocularis beta tubulin 0.0249 0.3086 0.4823
Leishmania major beta tubulin 0.0249 0.3086 1
Loa Loa (eye worm) hypothetical protein 0.0136 0.1364 0.1862
Echinococcus granulosus tubulin subunit beta 0.0249 0.3086 0.4823
Chlamydia trachomatis DNA gyrase subunit A 0.032 0.4174 0.5
Echinococcus granulosus tubulin alpha chain 0.0226 0.2731 0.4212
Loa Loa (eye worm) hypothetical protein 0.0507 0.7024 1
Loa Loa (eye worm) BEN-1 protein 0.0249 0.3086 0.4338
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Trypanosoma cruzi tubulin gamma chain 0.0151 0.1581 0.4635
Echinococcus granulosus Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Leishmania major beta tubulin 0.0249 0.3086 1
Plasmodium vivax tubulin epsilon chain, putative 0.0151 0.1581 0.334
Echinococcus multilocularis tubulin alpha 3 chain 0.0226 0.2731 0.4212
Leishmania major beta tubulin 0.0249 0.3086 1
Giardia lamblia Beta tubulin 0.0249 0.3086 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0226 0.2731 0.4212
Schistosoma mansoni tubulin subunit beta 0.0249 0.3086 0.4823
Leishmania major beta tubulin 0.0249 0.3086 1
Leishmania major epsilon tubulin, putative 0.0151 0.1581 0.4635
Brugia malayi Cytochrome P450 family protein 0.0051 0.0068 0.0112
Trichomonas vaginalis tubulin epsilon chain, putative 0.0249 0.3086 1
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Loa Loa (eye worm) hypothetical protein 0.0161 0.1733 0.2393
Loa Loa (eye worm) hypothetical protein 0.0419 0.5681 0.8069
Echinococcus granulosus geminin 0.0311 0.4027 0.6441
Trypanosoma cruzi beta tubulin, putative 0.0249 0.3086 1
Loa Loa (eye worm) tubulin beta-2A chain 0.0249 0.3086 0.4338
Leishmania major beta tubulin 0.0249 0.3086 1
Plasmodium falciparum tubulin epsilon chain, putative 0.0151 0.1581 0.334
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0136 0.1364 0.2237
Trichomonas vaginalis tubulin alpha chain, putative 0.0085 0.0584 0.1078
Loa Loa (eye worm) beta-tubulin 0.0249 0.3086 0.4338
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0085 0.0584 0.1078
Plasmodium vivax tubulin gamma chain, putative 0.0151 0.1581 0.334
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0294 0.0023
Schistosoma mansoni tubulin subunit epsilon 0.0151 0.1581 0.2235
Brugia malayi Tubulin alpha chain 0.0226 0.2731 0.4479
Trichomonas vaginalis tubulin gamma chain, putative 0.0151 0.1581 0.4635
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0161 0.1733 0.2393
Echinococcus granulosus tubulin alpha 1C chain 0.0226 0.2731 0.4212
Trichomonas vaginalis tubulin beta chain, putative 0.0226 0.2731 0.8733
Plasmodium vivax tubulin alpha chain, putative 0.0226 0.2731 0.6293
Entamoeba histolytica tubulin alpha chain, putative 0.0226 0.2731 0.7638
Echinococcus granulosus Tubulin beta 2C chain 0.0249 0.3086 0.4823
Echinococcus granulosus alpha tubulin 0.0226 0.2731 0.4212
Loa Loa (eye worm) tubulin alpha 2 0.0161 0.1733 0.2393
Echinococcus multilocularis tubulin alpha chain 0.0226 0.2731 0.4212
Treponema pallidum DNA gyrase, subunit A (gyrA) 0.032 0.4174 1

Activities

Activity type Activity value Assay description Source Reference
Kd (functional) = 5.7 Antagonist potency against carbachol induced contractions of isolated guinea pig ileum Muscarinic acetylcholine receptor ChEMBL. 2909747
Kd (functional) = 7.23 Antagonist potency against carbachol induced inhibition of electrically stimulated guinea pig atria Muscarinic acetylcholine receptor ChEMBL. 2909747
pA2 (functional) = 5.7 Antagonist potency against carbachol induced contractions of isolated guinea pig ileum Muscarinic acetylcholine receptor ChEMBL. 2909747
pA2 (functional) = 7.23 Antagonist potency against carbachol induced inhibition of electrically stimulated guinea pig atria Muscarinic acetylcholine receptor ChEMBL. 2909747
Ratio (functional) = 34 Selectivity ratio between antagonistic potency in atria and ileum ChEMBL. 2909747

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

1 literature reference was collected for this gene.

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