Detailed information for compound 912700

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 518.434 | Formula: C29H25Cl2N3O2
  • H donors: 0 H acceptors: 2 LogP: 5.27 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 2
  • SMILES: COC(c1cncn1C)(c1ccc2c(c1)c(cc(=O)n2C)c1cccc(c1C)Cl)c1ccc(cc1)Cl
  • InChi: 1S/C29H25Cl2N3O2/c1-18-22(6-5-7-25(18)31)23-15-28(35)34(3)26-13-10-20(14-24(23)26)29(36-4,27-16-32-17-33(27)2)19-8-11-21(30)12-9-19/h5-17H,1-4H3
  • InChiKey: URJAQUYCRCFSSV-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
Trypanosoma cruzi Lanosterol 14-alpha demethylase Curated by TDR Targets No references
Trypanosoma cruzi Lanosterol 14-alpha demethylase Curated by TDR Targets No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania infantum lanosterol 14-alpha-demethylase, putative Get druggable targets OG5_129288 All targets in OG5_129288
Candida albicans cytochrome P450 lanosterol 14-alpha -demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Trypanosoma brucei gambiense lanosterol 14-alpha-demethylase,cytochrome P450 51A1, putative Get druggable targets OG5_129288 All targets in OG5_129288
Leishmania major lanosterol 14-alpha-demethylase, putative Get druggable targets OG5_129288 All targets in OG5_129288
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 Get druggable targets OG5_129288 All targets in OG5_129288
Leishmania donovani Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Candida albicans cytochrome P450 lanosterol 14-alpha -demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) Get druggable targets OG5_129288 All targets in OG5_129288
Leishmania mexicana lanosterol 14-alpha-demethylase, putative Get druggable targets OG5_129288 All targets in OG5_129288
Trypanosoma cruzi Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Trypanosoma brucei Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Trypanosoma congolense Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Trypanosoma cruzi Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Leishmania braziliensis lanosterol 14-alpha-demethylase, putative Get druggable targets OG5_129288 All targets in OG5_129288
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 Lanosterol 14-alpha demethylase 481 aa 443 aa 24.6 %
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 Lanosterol 14-alpha demethylase 481 aa 443 aa 24.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) tubulin beta-2A chain 0.171729 1 1
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Giardia lamblia Alpha-tubulin 0.125095 0.721932 0.643616
Loa Loa (eye worm) alpha-tubulin 0.125095 0.721932 0.718498
Loa Loa (eye worm) tubulin alpha 2 0.0842189 0.478193 0.47175
Brugia malayi Tubulin gamma chain 0.0964063 0.550864 0.545318
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Leishmania major gamma-tubulin 0.0964063 0.550864 0.290011
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Loa Loa (eye worm) tubulin beta-4 chain 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Brugia malayi Tubulin alpha chain 0.0408765 0.219751 0.210117
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0408765 0.219751 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin alpha 3 chain 0.125095 0.721932 0.718498
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Schistosoma mansoni tubulin subunit gamma 0.0964063 0.550864 0.545318
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0923173 0.526482 0.526482
Giardia lamblia Epsilon tubulin 0.0448994 0.243739 0.0307437
Echinococcus granulosus tubulin delta chain 0.0408765 0.219751 0.210117
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Leishmania major beta tubulin 0.171729 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.171729 1 1
Echinococcus multilocularis tubulin alpha 1C chain 0.125095 0.721932 0.718498
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Echinococcus granulosus peroxisome assembly protein 26 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin beta chain, putative 0.171729 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Loa Loa (eye worm) tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma brucei zeta tubulin, putative 0.0821106 0.465622 0.254969
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Leishmania major beta tubulin 0.171729 1 1
Trypanosoma cruzi alpha tubulin, putative 0.125095 0.721932 0.712733
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Schistosoma mansoni tubulin subunit delta 0.0408765 0.219751 0.210117
Brugia malayi Tubulin alpha-2 chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) tubulin alpha 2 0.0842189 0.478193 0.47175
Trypanosoma brucei beta tubulin 0.0923173 0.526482 0.339821
Giardia lamblia Beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) beta-tubulin 0.171729 1 1
Trypanosoma cruzi zeta tubulin, putative 0.0821106 0.465622 0.447944
Brugia malayi tubulin alpha-2 chain 0.125095 0.721932 0.718498
Trypanosoma cruzi beta tubulin, putative 0.171729 1 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Leishmania major beta tubulin 0.171729 1 1
Loa Loa (eye worm) tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Loa Loa (eye worm) tubulin alpha-3 chain 0.0736546 0.4152 0.40798
Leishmania major beta tubulin 0.171729 1 1
Plasmodium vivax tubulin gamma chain, putative 0.0964063 0.550864 0.424369
Echinococcus multilocularis tubulin alpha 3 chain 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin, putative 0.0514408 0.282744 0.0807341
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0656389 0.367404 0.367404
Brugia malayi Tubulin beta chain 0.0514408 0.282744 0.273888
Trypanosoma cruzi tubulin delta chain 0.0656389 0.367404 0.346477
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Toxoplasma gondii beta-tubulin, putative 0.171729 1 1
Trichomonas vaginalis tubulin, putative 0.171729 1 1
Echinococcus granulosus alpha tubulin 0.125095 0.721932 0.718498
Plasmodium falciparum alpha tubulin 2 0.125095 0.721932 0.643616
Echinococcus granulosus beta tubulin 0.171729 1 1
Trypanosoma brucei epsilon tubulin 0.0963402 0.55047 0.373265
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0514408 0.282744 0.0807341
Toxoplasma gondii alpha-tubulin I, putative 0.125095 0.721932 0.721932
Onchocerca volvulus 0.0514408 0.282744 1
Plasmodium vivax tubulin alpha chain, putative 0.125095 0.721932 0.643616
Schistosoma mansoni tubulin subunit beta 0.0408765 0.219751 0.210117
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus granulosus tubulin alpha 1C chain 0.125095 0.721932 0.718498
Plasmodium vivax tubulin epsilon chain, putative 0.0963402 0.55047 0.423864
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0736546 0.4152 0.250496
Entamoeba histolytica tubulin alpha-1 chain 0.125095 0.721932 0.380882
Leishmania major beta tubulin 0.171729 1 1
Brugia malayi beta-tubulin, identical 0.171729 1 1
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Trypanosoma brucei beta tubulin 0.171729 1 1
Giardia lamblia Beta tubulin 0.171729 1 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Trypanosoma brucei epsilon tubulin 0.0963402 0.55047 0.373265
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus granulosus tubulin gamma 1 chain 0.0964063 0.550864 0.545318
Loa Loa (eye worm) tubulin alpha 2 0.0327781 0.171462 0.161232
Echinococcus granulosus tubulin alpha 1C chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) tubulin beta chain 0.0408765 0.219751 0.210117
Leishmania major beta tubulin 0.171729 1 1
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Trypanosoma cruzi epsilon tubulin, putative 0.0963402 0.55047 0.535599
Brugia malayi alpha-tubulin 0.125095 0.721932 0.718498
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Loa Loa (eye worm) tubulin beta chain 0.171729 1 1
Brugia malayi Tubulin alpha-2 chain 0.125095 0.721932 0.718498
Echinococcus granulosus tubulin alpha 3 chain 0.125095 0.721932 0.718498
Brugia malayi prostaglandin transporter 0.00939316 0.0320219 0.0200701
Loa Loa (eye worm) hypothetical protein 0.0736546 0.4152 0.40798
Brugia malayi tubulin alpha chain - mouse 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin gamma 1 chain 0.0964063 0.550864 0.545318
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0842189 0.478193 0.47175
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Loa Loa (eye worm) tubulin gamma chain 0.0964063 0.550864 0.545318
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Trichomonas vaginalis tubulin, putative 0.0449655 0.244133 0.0312486
Treponema pallidum cell division protein FtsZ 0.0408765 0.219751 0.5
Loa Loa (eye worm) tubulin beta-1 chain 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0514408 0.282744 0.0807341
Trypanosoma brucei epsilon tubulin 0.0923173 0.526482 0.339821
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Trypanosoma brucei beta tubulin 0.171729 1 1
Trypanosoma cruzi epsilon tubulin, putative 0.0963402 0.55047 0.535599
Brugia malayi hypothetical protein 0.00939316 0.0320219 0.0200701
Echinococcus multilocularis tubulin epsilon chain 0.0963402 0.55047 0.54492
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Echinococcus multilocularis tubulin subunit beta 0.171729 1 1
Echinococcus granulosus beta tubulin 0.171729 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Echinococcus multilocularis beta tubulin 0.171729 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Echinococcus granulosus tubulin subunit beta 0.171729 1 1
Schistosoma mansoni organic anion transporter 0.00939316 0.0320219 0.0200701
Trichomonas vaginalis tubulin, putative 0.0514408 0.282744 0.0807341
Plasmodium vivax tubulin alpha chain, putative 0.125095 0.721932 0.643616
Echinococcus granulosus organic anion transporting polypeptide 30B 0.00939316 0.0320219 0.0200701
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Toxoplasma gondii protease inhibitor PI2 0.00606834 0.0121966 0.0121966
Brugia malayi Tubulin alpha chain 0.125095 0.721932 0.718498
Plasmodium falciparum tubulin beta chain 0.171729 1 1
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Toxoplasma gondii alpha tubulin TUBA1 0.125095 0.721932 0.721932
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Plasmodium falciparum alpha tubulin 1 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Echinococcus multilocularis hypothetical protein 0.125095 0.721932 0.718498
Mycobacterium tuberculosis Cell division protein FtsZ 0.0408765 0.219751 0.5
Plasmodium vivax tubulin beta chain, putative 0.171729 1 1
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Leishmania major beta tubulin 0.171729 1 1
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin alpha 1C chain 0.125095 0.721932 0.718498
Echinococcus granulosus tubulin alpha 3 chain 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin alpha 0.0923173 0.526482 0.520636
Schistosoma mansoni organic anion transporter 0.00939316 0.0320219 0.0200701
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Trypanosoma brucei beta tubulin 0.171729 1 1
Echinococcus granulosus tubulin epsilon chain 0.0963402 0.55047 0.54492
Echinococcus granulosus tubulin subunit TubB 0.125095 0.721932 0.718498
Loa Loa (eye worm) hypothetical protein 0.125095 0.721932 0.718498
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Leishmania major beta tubulin 0.171729 1 1
Brugia malayi Tubulin beta chain 0.0408765 0.219751 0.210117
Trichomonas vaginalis tubulin gamma chain, putative 0.171729 1 1
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) hypothetical protein 0.0842189 0.478193 0.47175
Brugia malayi Tubulin beta-1 chain 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Echinococcus granulosus tubulin alpha 0.0923173 0.526482 0.520636
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Toxoplasma gondii beta tubulin 0.171729 1 1
Schistosoma mansoni tubulin subunit epsilon 0.0963402 0.55047 0.54492
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma cruzi tubulin gamma chain 0.0964063 0.550864 0.536006
Mycobacterium ulcerans cell division protein FtsZ 0.0408765 0.219751 0.5
Echinococcus multilocularis tubulin, beta 4A class IVa 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Mycobacterium leprae cell division protein FtsZ 0.0408765 0.219751 0.5
Giardia lamblia Beta tubulin 0.171729 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0448994 0.243739 0.243739
Trypanosoma brucei tubulin gamma chain 0.0964063 0.550864 0.373814
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Echinococcus multilocularis tubulin subunit TubB 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin alpha chain, putative 0.0923173 0.526482 0.39312
Trypanosoma cruzi tubulin delta chain 0.0656389 0.367404 0.346477
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Trichomonas vaginalis tubulin epsilon chain, putative 0.171729 1 1
Entamoeba histolytica tubulin family protein 0.171729 1 1
Trypanosoma cruzi zeta tubulin, putative 0.0821106 0.465622 0.447944
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin epsilon chain, putative 0.125095 0.721932 0.643616
Echinococcus granulosus tubulin beta 4A class IVa 0.171729 1 1
Giardia lamblia Alpha-tubulin 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin gamma chain, putative 0.0963402 0.55047 0.423864
Echinococcus granulosus Solute carrier organic anion transporter family 0.00939316 0.0320219 0.0200701
Giardia lamblia Gamma tubulin 0.0964063 0.550864 0.424369
Toxoplasma gondii transporter, major facilitator family protein 0.00939316 0.0320219 0.0320219
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Loa Loa (eye worm) sodium-independent organic anion transporter 0.00939316 0.0320219 0.0200701
Leishmania major beta tubulin 0.171729 1 1
Brugia malayi Cell division protein ftsZ 0.0408765 0.219751 0.210117
Loa Loa (eye worm) tubulin alpha-2 chain 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin beta 1 chain 0.171729 1 1
Toxoplasma gondii beta-1 tubulin, putative 0.171729 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0842189 0.478193 0.33123
Schistosoma mansoni tubulin subunit alpha 0.0408765 0.219751 0.210117
Trichomonas vaginalis tubulin gamma chain, putative 0.0964063 0.550864 0.424369
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma brucei zeta tubulin 0.0821106 0.465622 0.254969
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Trypanosoma brucei tubulin delta chain 0.0656389 0.367404 0.118034
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Echinococcus multilocularis beta tubulin 0.171729 1 1
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Brugia malayi hypothetical protein 0.00939316 0.0320219 0.0200701
Echinococcus multilocularis Solute carrier organic anion transporter family 0.00939316 0.0320219 0.0200701
Trichomonas vaginalis tubulin alpha chain, putative 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin delta chain 0.0408765 0.219751 0.210117
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis peroxisome assembly protein 26 0.125095 0.721932 0.718498
Loa Loa (eye worm) alpha-tubulin 0.125095 0.721932 0.718498
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Plasmodium falciparum tubulin gamma chain 0.0964063 0.550864 0.424369
Loa Loa (eye worm) BEN-1 protein 0.171729 1 1
Entamoeba histolytica tubulin family protein 0.171729 1 1
Leishmania major epsilon tubulin, putative 0.0963402 0.55047 0.289389
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.125095 0.721932 0.643616
Plasmodium falciparum tubulin epsilon chain, putative 0.0963402 0.55047 0.423864
Echinococcus granulosus tubulin beta 1 chain 0.171729 1 1
Leishmania major zeta tubulin, putative 0.0821106 0.465622 0.155262
Entamoeba histolytica tubulin alpha chain, putative 0.125095 0.721932 0.380882
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin epsilon chain, putative 0.125095 0.721932 0.643616
Leishmania major beta tubulin 0.171729 1 1
Loa Loa (eye worm) BEN-1 protein 0.171729 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Trypanosoma brucei beta tubulin 0.171729 1 1
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.00939316 0.0320219 0.0200701

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.6 nM Antitrypanosomal activity against Trypanosoma cruzi Tulahuen amastigotes infected in rat 3T3 cells after 7 days by alamar blue assay ChEMBL. 20429511
Ratio EC50 (functional) = 10 Ratio of EC50 for tipifarnib to drug for antitrypanosomal activity against Trypanosoma cruzi Tulahuen amastigotes infected in rat 3T3 cells after 7 days by alamar blue assay ChEMBL. 20429511

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Trypanosoma cruzi ChEMBL23 20429511

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:

Affected Entity Phenotypic quality Occurs in Occurs at Evidence Observed in Targets
growth (GO:0040007) lethal (sensu genetics) (PATO:0000718) inferred from animal model system (ECO:0000179) Trypanosoma cruzi 46252  
Annotator: millerja@u.washington.edu Comment: Compound 2g in referenced publication References: 19239254
growth (GO:0040007) lethal (sensu genetics) (PATO:0000718) inferred from animal model system (ECO:0000179) Trypanosoma cruzi 31242  
Annotator: millerja@u.washington.edu Comment: Compound 2g in referenced publication References: 19239254

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

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