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 donovani 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
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 braziliensis 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
Candida albicans cytochrome P450 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 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 gambiense lanosterol 14-alpha-demethylase,cytochrome P450 51A1, putative 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
Trypanosoma congolense Lanosterol 14-alpha demethylase Get druggable targets OG5_129288 All targets in OG5_129288
Leishmania infantum 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
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Loa Loa (eye worm) tubulin beta chain 0.171729 1 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis beta tubulin 0.171729 1 1
Trypanosoma cruzi zeta tubulin, putative 0.0821106 0.465622 0.447944
Trichomonas vaginalis tubulin, putative 0.0514408 0.282744 0.0807341
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Echinococcus granulosus tubulin alpha 0.0923173 0.526482 0.520636
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis tubulin alpha 3 chain 0.125095 0.721932 0.718498
Toxoplasma gondii alpha tubulin TUBA1 0.125095 0.721932 0.721932
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Echinococcus multilocularis peroxisome assembly protein 26 0.125095 0.721932 0.718498
Trypanosoma cruzi tubulin delta chain 0.0656389 0.367404 0.346477
Leishmania major beta tubulin 0.171729 1 1
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Loa Loa (eye worm) tubulin beta-2A chain 0.171729 1 1
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Mycobacterium tuberculosis Cell division protein FtsZ 0.0408765 0.219751 0.5
Leishmania major epsilon tubulin, putative 0.0963402 0.55047 0.289389
Echinococcus multilocularis tubulin alpha 0.0923173 0.526482 0.520636
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Toxoplasma gondii transporter, major facilitator family protein 0.00939316 0.0320219 0.0320219
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Trypanosoma brucei epsilon tubulin 0.0963402 0.55047 0.373265
Echinococcus multilocularis tubulin subunit beta 0.171729 1 1
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Echinococcus granulosus tubulin gamma 1 chain 0.0964063 0.550864 0.545318
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) BEN-1 protein 0.171729 1 1
Loa Loa (eye worm) beta-tubulin 0.171729 1 1
Echinococcus granulosus Solute carrier organic anion transporter family 0.00939316 0.0320219 0.0200701
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Brugia malayi Tubulin alpha chain 0.0408765 0.219751 0.210117
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Trypanosoma brucei beta tubulin 0.171729 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.171729 1 1
Plasmodium falciparum alpha tubulin 1 0.125095 0.721932 0.643616
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Trypanosoma brucei epsilon tubulin 0.0923173 0.526482 0.339821
Trichomonas vaginalis tubulin gamma chain, putative 0.0963402 0.55047 0.423864
Brugia malayi Tubulin gamma chain 0.0964063 0.550864 0.545318
Echinococcus granulosus tubulin epsilon chain 0.0963402 0.55047 0.54492
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Trypanosoma brucei tubulin gamma chain 0.0964063 0.550864 0.373814
Leishmania major beta tubulin 0.171729 1 1
Trypanosoma cruzi epsilon tubulin, putative 0.0963402 0.55047 0.535599
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Schistosoma mansoni tubulin subunit epsilon 0.0963402 0.55047 0.54492
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Mycobacterium ulcerans cell division protein FtsZ 0.0408765 0.219751 0.5
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Trypanosoma cruzi alpha tubulin, putative 0.125095 0.721932 0.712733
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma cruzi zeta tubulin, putative 0.0821106 0.465622 0.447944
Echinococcus multilocularis tubulin gamma 1 chain 0.0964063 0.550864 0.545318
Trypanosoma cruzi beta tubulin, putative 0.171729 1 1
Plasmodium vivax tubulin beta chain, putative 0.171729 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.0842189 0.478193 0.47175
Loa Loa (eye worm) tubulin alpha chain 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0842189 0.478193 0.33123
Echinococcus granulosus tubulin subunit beta 0.171729 1 1
Echinococcus multilocularis tubulin delta chain 0.0408765 0.219751 0.210117
Leishmania major beta tubulin 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.0736546 0.4152 0.40798
Leishmania major beta tubulin 0.171729 1 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus granulosus tubulin alpha 1C chain 0.125095 0.721932 0.718498
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Trichomonas vaginalis tubulin gamma chain, putative 0.0964063 0.550864 0.424369
Brugia malayi tubulin alpha-2 chain 0.125095 0.721932 0.718498
Trypanosoma brucei epsilon tubulin 0.0963402 0.55047 0.373265
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Entamoeba histolytica tubulin alpha chain, putative 0.125095 0.721932 0.380882
Plasmodium vivax tubulin gamma chain, putative 0.0964063 0.550864 0.424369
Schistosoma mansoni organic anion transporter 0.00939316 0.0320219 0.0200701
Trypanosoma brucei beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin epsilon chain 0.0963402 0.55047 0.54492
Loa Loa (eye worm) tubulin beta-4 chain 0.171729 1 1
Brugia malayi hypothetical protein 0.00939316 0.0320219 0.0200701
Plasmodium vivax tubulin alpha chain, putative 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin epsilon chain, putative 0.125095 0.721932 0.643616
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0408765 0.219751 0.5
Loa Loa (eye worm) BEN-1 protein 0.171729 1 1
Brugia malayi tubulin alpha chain - mouse 0.125095 0.721932 0.718498
Schistosoma mansoni tubulin subunit alpha 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin epsilon chain, putative 0.125095 0.721932 0.643616
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Loa Loa (eye worm) tubulin alpha-3 chain 0.0736546 0.4152 0.40798
Echinococcus granulosus tubulin alpha 1C chain 0.125095 0.721932 0.718498
Echinococcus granulosus organic anion transporting polypeptide 30B 0.00939316 0.0320219 0.0200701
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Echinococcus granulosus tubulin alpha 3 chain 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Plasmodium falciparum tubulin beta chain 0.171729 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Trichomonas vaginalis tubulin, putative 0.0449655 0.244133 0.0312486
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) sodium-independent organic anion transporter 0.00939316 0.0320219 0.0200701
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Leishmania major beta tubulin 0.171729 1 1
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Trypanosoma cruzi tubulin gamma chain 0.0964063 0.550864 0.536006
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Echinococcus granulosus tubulin delta chain 0.0408765 0.219751 0.210117
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Schistosoma mansoni organic anion transporter 0.00939316 0.0320219 0.0200701
Brugia malayi Tubulin beta chain 0.0514408 0.282744 0.273888
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Brugia malayi sodium-independent organic anion transporter family protein 0.00939316 0.0320219 0.0200701
Brugia malayi Tubulin alpha-2 chain 0.125095 0.721932 0.718498
Entamoeba histolytica tubulin family protein 0.171729 1 1
Trichomonas vaginalis tubulin, putative 0.0514408 0.282744 0.0807341
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0923173 0.526482 0.526482
Brugia malayi beta-tubulin, identical 0.171729 1 1
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis tubulin beta 1 chain 0.171729 1 1
Echinococcus multilocularis beta tubulin 0.171729 1 1
Echinococcus granulosus tubulin beta 4A class IVa 0.171729 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Echinococcus multilocularis tubulin alpha 3 chain 0.125095 0.721932 0.718498
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Giardia lamblia Gamma tubulin 0.0964063 0.550864 0.424369
Loa Loa (eye worm) hypothetical protein 0.125095 0.721932 0.718498
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Echinococcus granulosus tubulin subunit TubB 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Trypanosoma cruzi epsilon tubulin, putative 0.0963402 0.55047 0.535599
Loa Loa (eye worm) tubulin alpha-2 chain 0.125095 0.721932 0.718498
Schistosoma mansoni tubulin subunit gamma 0.0964063 0.550864 0.545318
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0514408 0.282744 0.0807341
Echinococcus granulosus alpha tubulin 0.125095 0.721932 0.718498
Schistosoma mansoni tubulin subunit alpha 0.0408765 0.219751 0.210117
Plasmodium falciparum tubulin epsilon chain, putative 0.0963402 0.55047 0.423864
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Brugia malayi Tubulin alpha chain 0.125095 0.721932 0.718498
Schistosoma mansoni tubulin subunit delta 0.0408765 0.219751 0.210117
Leishmania major beta tubulin 0.171729 1 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis tubulin alpha 1C chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) tubulin beta chain 0.0408765 0.219751 0.210117
Giardia lamblia Beta tubulin 0.171729 1 1
Entamoeba histolytica tubulin alpha-1 chain 0.125095 0.721932 0.380882
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Echinococcus multilocularis Solute carrier organic anion transporter family 0.00939316 0.0320219 0.0200701
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Leishmania major zeta tubulin, putative 0.0821106 0.465622 0.155262
Loa Loa (eye worm) tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin alpha chain 0.125095 0.721932 0.718498
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Echinococcus multilocularis hypothetical protein 0.125095 0.721932 0.718498
Loa Loa (eye worm) alpha-tubulin 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin beta chain, putative 0.0514408 0.282744 0.0807341
Entamoeba histolytica tubulin family protein 0.171729 1 1
Loa Loa (eye worm) tubulin gamma chain 0.0964063 0.550864 0.545318
Trypanosoma brucei zeta tubulin, putative 0.0821106 0.465622 0.254969
Schistosoma mansoni tubulin subunit beta 0.171729 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Echinococcus granulosus tubulin beta 1 chain 0.171729 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Trypanosoma brucei tubulin delta chain 0.0656389 0.367404 0.118034
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0448994 0.243739 0.243739
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Leishmania major beta tubulin 0.171729 1 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Trichomonas vaginalis tubulin epsilon chain, putative 0.171729 1 1
Leishmania major gamma-tubulin 0.0964063 0.550864 0.290011
Echinococcus granulosus beta tubulin 0.171729 1 1
Giardia lamblia Beta tubulin 0.171729 1 1
Echinococcus granulosus peroxisome assembly protein 26 0.125095 0.721932 0.718498
Onchocerca volvulus Putative organic anion transporter 0.00939316 0.0320219 0.0732786
Brugia malayi Tubulin alpha-2 chain 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Toxoplasma gondii beta-tubulin, putative 0.171729 1 1
Trypanosoma brucei zeta tubulin 0.0821106 0.465622 0.254969
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Echinococcus multilocularis tubulin subunit TubB 0.125095 0.721932 0.718498
Brugia malayi prostaglandin transporter 0.00939316 0.0320219 0.0200701
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Trypanosoma brucei beta tubulin 0.171729 1 1
Giardia lamblia Epsilon tubulin 0.0448994 0.243739 0.0307437
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Plasmodium falciparum tubulin gamma chain 0.0964063 0.550864 0.424369
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.00606834 0.0121966 0.0121966
Toxoplasma gondii protease inhibitor PI2 0.00606834 0.0121966 0.0121966
Loa Loa (eye worm) tubulin alpha 2 0.0842189 0.478193 0.47175
Loa Loa (eye worm) tubulin alpha 2 0.0842189 0.478193 0.47175
Toxoplasma gondii beta tubulin 0.171729 1 1
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Giardia lamblia Alpha-tubulin 0.125095 0.721932 0.643616
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Loa Loa (eye worm) alpha-tubulin 0.125095 0.721932 0.718498
Brugia malayi Tubulin beta chain 0.0408765 0.219751 0.210117
Schistosoma mansoni alpha tubulin 0.125095 0.721932 0.718498
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.00939316 0.0320219 0.0200701
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Trypanosoma brucei alpha tubulin 0.125095 0.721932 0.612317
Echinococcus granulosus Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Plasmodium vivax tubulin epsilon chain, putative 0.0963402 0.55047 0.423864
Echinococcus multilocularis tubulin, beta 4A class IVa 0.171729 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.125095 0.721932 0.643616
Echinococcus granulosus tubulin alpha chain 0.125095 0.721932 0.718498
Echinococcus multilocularis Tubulin beta 2C chain 0.171729 1 1
Schistosoma mansoni tubulin subunit beta 0.0408765 0.219751 0.210117
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Onchocerca volvulus 0.00939316 0.0320219 0.0732786
Mycobacterium leprae cell division protein FtsZ 0.0408765 0.219751 0.5
Leishmania major beta tubulin 0.171729 1 1
Loa Loa (eye worm) tubulin beta-1 chain 0.171729 1 1
Brugia malayi Tubulin beta-1 chain 0.171729 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Brugia malayi alpha-tubulin 0.125095 0.721932 0.718498
Echinococcus multilocularis Tubulin alpha 1 chain 0.125095 0.721932 0.718498
Trypanosoma cruzi tubulin delta chain 0.0656389 0.367404 0.346477
Trypanosoma brucei beta tubulin 0.0923173 0.526482 0.339821
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0842189 0.478193 0.47175
Trichomonas vaginalis tubulin beta chain, putative 0.125095 0.721932 0.643616
Loa Loa (eye worm) tubulin alpha 2 0.0327781 0.171462 0.161232
Trichomonas vaginalis tubulin beta chain, putative 0.171729 1 1
Brugia malayi Cell division protein ftsZ 0.0408765 0.219751 0.210117
Echinococcus multilocularis tubulin alpha 1C chain 0.125095 0.721932 0.718498
Brugia malayi hypothetical protein 0.00939316 0.0320219 0.0200701
Onchocerca volvulus 0.0514408 0.282744 1
Leishmania major alpha tubulin 0.125095 0.721932 0.560433
Echinococcus granulosus beta tubulin 0.171729 1 1
Plasmodium falciparum alpha tubulin 2 0.125095 0.721932 0.643616
Toxoplasma gondii alpha-tubulin I, putative 0.125095 0.721932 0.721932
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0736546 0.4152 0.250496
Trichomonas vaginalis tubulin alpha chain, putative 0.171729 1 1
Toxoplasma gondii beta-1 tubulin, putative 0.171729 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.171729 1 1
Treponema pallidum cell division protein FtsZ 0.0408765 0.219751 0.5
Giardia lamblia Beta tubulin 0.171729 1 1
Trichomonas vaginalis tubulin, putative 0.171729 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0514408 0.282744 0.0807341
Echinococcus granulosus tubulin alpha 3 chain 0.125095 0.721932 0.718498
Leishmania major beta tubulin 0.171729 1 1
Trypanosoma brucei beta tubulin 0.171729 1 1
Plasmodium vivax tubulin alpha chain, putative 0.125095 0.721932 0.643616
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0656389 0.367404 0.367404
Trichomonas vaginalis tubulin alpha chain, putative 0.0923173 0.526482 0.39312
Loa Loa (eye worm) hypothetical protein 0.00939316 0.0320219 0.0200701
Leishmania major beta tubulin 0.171729 1 1
Giardia lamblia Alpha-tubulin 0.125095 0.721932 0.643616

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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