Detailed information for compound 609207

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 464.557 | Formula: C26H32N4O4
  • H donors: 0 H acceptors: 4 LogP: 2.67 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCn1c(=O)c2ccc3c4c2c(c1=O)ccc4c(=O)n(c3=O)CCN(CC)CC)CC
  • InChi: 1S/C26H32N4O4/c1-5-27(6-2)13-15-29-23(31)17-9-11-19-22-20(12-10-18(21(17)22)24(29)32)26(34)30(25(19)33)16-14-28(7-3)8-4/h9-12H,5-8,13-16H2,1-4H3
  • InChiKey: BVJPPBWWKKDUGR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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 0.125601 0.744498 0.743963
Trypanosoma brucei alpha tubulin 0.125601 0.744498 0.687092
Trichomonas vaginalis tubulin alpha chain, putative 0.16764 1 1
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.033292 0.183461 0.183461
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0909934 0.534159 0.531131
Echinococcus granulosus epidermal growth factor receptor 0.0179014 0.0899205 0.0880152
Schistosoma mansoni carbonic anhydrase 0.0123616 0.0562504 0.0562504
Echinococcus granulosus integrin alpha ps 0.00793363 0.0293381 0.0273061
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.033292 0.183461 0.183461
Echinococcus multilocularis tyrosine protein kinase ABL1 0.0252791 0.13476 0.132949
Echinococcus granulosus beta tubulin 0.16764 1 1
Schistosoma mansoni tyrosine kinase 0.0172769 0.0861249 0.0861249
Echinococcus multilocularis follistatin 0.00416914 0.0064583 0.0043783
Schistosoma mansoni gliotactin 0.00440208 0.00787409 0.00787409
Toxoplasma gondii alpha-tubulin I, putative 0.125601 0.744498 0.742838
Mycobacterium ulcerans cell division protein FtsZ 0.0418861 0.235695 1
Entamoeba histolytica tubulin gamma chain 0.100955 0.594703 0.592493
Echinococcus granulosus carbonic anhydrase 0.0123616 0.0562504 0.0542746
Mycobacterium leprae cell division protein FtsZ 0.0418861 0.235695 0.5
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Loa Loa (eye worm) tubulin beta-1 chain 0.16764 1 1
Echinococcus multilocularis tubulin alpha 3 chain 0.125601 0.744498 0.743963
Trichomonas vaginalis tubulin alpha chain, putative 0.0928459 0.545419 0.541811
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.00416914 0.0064583 0.00469346
Trypanosoma cruzi zeta tubulin, putative 0.123659 0.732696 0.727145
Loa Loa (eye worm) integrin beta-2 0.0366767 0.204033 0.20398
Echinococcus multilocularis tyrosine protein kinase Src42A 0.00415849 0.00639358 0.00431344
Trypanosoma brucei epsilon tubulin 0.100824 0.593907 0.502665
Echinococcus granulosus agrin 0.00416914 0.0064583 0.0043783
Echinococcus granulosus tyrosine protein kinase Blk 0.00478299 0.0101892 0.00811697
Echinococcus granulosus tubulin beta 1 chain 0.16764 1 1
Loa Loa (eye worm) TK/KIN16 protein kinase 0.00339828 0.00177317 0.00170655
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.00440208 0.00787409 0.00787409
Schistosoma mansoni agrin 0.00416914 0.0064583 0.0064583
Plasmodium falciparum tubulin beta chain 0.16764 1 1
Giardia lamblia Gamma tubulin 0.100955 0.594703 0.469719
Loa Loa (eye worm) sodium-independent organic anion transporter 0.0064534 0.0203416 0.0202762
Toxoplasma gondii hypothetical protein 0.0123616 0.0562504 0.0501158
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.00554761 0.0148364 0.0127739
Brugia malayi Carboxylesterase family protein 0.0260531 0.139465 0.137937
Schistosoma mansoni BC026374 protein (S09 family) 0.00440208 0.00787409 0.00787409
Echinococcus multilocularis tyrosine protein kinase Fgr 0.00554761 0.0148364 0.0127739
Echinococcus granulosus tyrosine protein kinase HCK 0.0039989 0.00542363 0.00334146
Echinococcus multilocularis para nitrobenzyl esterase 0.00440208 0.00787409 0.00579705
Loa Loa (eye worm) tubulin gamma chain 0.100955 0.594703 0.594676
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.00440208 0.00787409 0.00787409
Echinococcus granulosus Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Brugia malayi Tubulin alpha chain 0.0418861 0.235695 0.234337
Trypanosoma brucei beta tubulin 0.16764 1 1
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.033292 0.183461 0.166507
Brugia malayi secreted modular calcium-binding protein 1 0.00416914 0.0064583 0.00469346
Trichomonas vaginalis tubulin beta-1 chain, putative 0.0418861 0.235695 0.229629
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.00440208 0.00787409 0.00787409
Echinococcus multilocularis BC026374 protein (S09 family) 0.00440208 0.00787409 0.00579705
Echinococcus multilocularis tubulin alpha 0.0928459 0.545419 0.544467
Schistosoma mansoni tubulin subunit epsilon 0.100824 0.593907 0.593907
Echinococcus multilocularis tubulin, beta 4A class IVa 0.16764 1 1
Echinococcus multilocularis tubulin alpha 1C chain 0.125601 0.744498 0.743963
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Loa Loa (eye worm) kazal-type serine protease inhibitor domain-containing protein 0.00416914 0.0064583 0.00639199
Loa Loa (eye worm) tubulin alpha 2 0.0327552 0.180199 0.180144
Entamoeba histolytica tubulin alpha-1 chain 0.125601 0.744498 0.743105
Onchocerca volvulus 0.0064534 0.0203416 0.0488187
Schistosoma mansoni integrin beta subunit 0.0217737 0.113455 0.113455
Echinococcus granulosus acetylcholinesterase 0.0260531 0.139465 0.137663
Echinococcus multilocularis acetylcholinesterase 0.0260531 0.139465 0.137663
Echinococcus multilocularis Tubulin beta 2C chain 0.16764 1 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.00554761 0.0148364 0.0127739
Schistosoma mansoni tyrosine kinase 0.0172769 0.0861249 0.0861249
Loa Loa (eye worm) alpha-tubulin 0.125601 0.744498 0.744481
Leishmania major beta tubulin 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.00550764 0.0145935 0.0145277
Brugia malayi Carboxylesterase family protein 0.00440208 0.00787409 0.00611176
Plasmodium falciparum tubulin gamma chain 0.100955 0.594703 0.570547
Echinococcus multilocularis integrin alpha ps 0.0038029 0.00423235 0.00214769
Loa Loa (eye worm) alpha-tubulin isotype 2 0.083715 0.489923 0.489889
Trypanosoma brucei epsilon tubulin 0.0928459 0.545419 0.443282
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Trichomonas vaginalis tubulin, putative 0.0509598 0.290843 0.285215
Loa Loa (eye worm) hypothetical protein 0.0123616 0.0562504 0.0561874
Trypanosoma brucei beta tubulin 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Echinococcus multilocularis integrin beta 2 0.0272813 0.14693 0.145144
Trypanosoma brucei beta tubulin 0.16764 1 1
Trypanosoma cruzi tubulin delta chain 0.0909934 0.534159 0.524486
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.0064534 0.0203416 0.0182907
Echinococcus granulosus Tubulin beta 2C chain 0.16764 1 1
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.00416914 0.0064583 0.00469346
Trichomonas vaginalis tubulin gamma chain, putative 0.100955 0.594703 0.591487
Loa Loa (eye worm) hypothetical protein 0.0746413 0.434775 0.434737
Toxoplasma gondii transporter, major facilitator family protein 0.0064534 0.0203416 0.0139735
Echinococcus multilocularis tyrosine protein kinase HCK 0.0039989 0.00542363 0.00334146
Loa Loa (eye worm) carboxylesterase 0.00440208 0.00787409 0.00780788
Schistosoma mansoni integrin alpha-ps 0.00413073 0.00622488 0.00622488
Loa Loa (eye worm) TK/ABL protein kinase 0.0252791 0.13476 0.134703
Loa Loa (eye worm) tubulin beta chain 0.0418861 0.235695 0.235644
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0746413 0.434775 0.430289
Leishmania major beta tubulin 0.16764 1 1
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.0120332 0.0542545 0.0522745
Echinococcus granulosus Tubulin beta 2C chain 0.16764 1 1
Echinococcus granulosus Solute carrier organic anion transporter family 0.0064534 0.0203416 0.0182907
Schistosoma mansoni carbonic anhydrase-related 0.0123616 0.0562504 0.0562504
Echinococcus multilocularis epidermal growth factor receptor 0.0179014 0.0899205 0.0880152
Onchocerca volvulus 0.0509598 0.290843 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.00509381 0.0120783 0.0120124
Schistosoma mansoni tyrosine kinase 0.010825 0.0469115 0.0469115
Loa Loa (eye worm) SRC-1 0.00554761 0.0148364 0.0147707
Plasmodium falciparum alpha tubulin 2 0.125601 0.744498 0.72927
Brugia malayi protein-tyrosine kinase 0.00478299 0.0101892 0.00843094
Echinococcus multilocularis Tubulin beta 2C chain 0.16764 1 1
Echinococcus granulosus carbonic anhydrase 0.0123616 0.0562504 0.0542746
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Toxoplasma gondii beta-1 tubulin, putative 0.16764 1 1
Echinococcus multilocularis carbonic anhydrase 0.0123616 0.0562504 0.0542746
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0123616 0.0562504 0.0561874
Loa Loa (eye worm) hypothetical protein 0.00509381 0.0120783 0.0120124
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Schistosoma mansoni organic anion transporter 0.0064534 0.0203416 0.0203416
Echinococcus granulosus carboxylesterase 5A 0.0260531 0.139465 0.137663
Leishmania major zeta tubulin, putative 0.123659 0.732696 0.672637
Echinococcus multilocularis Tubulin beta 2C chain 0.16764 1 1
Echinococcus granulosus tubulin alpha 1C chain 0.125601 0.744498 0.743963
Brugia malayi Tubulin beta chain 0.0418861 0.235695 0.234337
Brugia malayi beta-tubulin, identical 0.16764 1 1
Echinococcus multilocularis tubulin alpha 1C chain 0.125601 0.744498 0.743963
Echinococcus granulosus Tubulin beta 2C chain 0.16764 1 1
Plasmodium vivax tubulin gamma chain, putative 0.100955 0.594703 0.469719
Brugia malayi Carboxylesterase family protein 0.00440208 0.00787409 0.00611176
Echinococcus multilocularis beta tubulin 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Brugia malayi hypothetical protein 0.00550764 0.0145935 0.0128431
Echinococcus granulosus acetylcholinesterase 0.0260531 0.139465 0.137663
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.125601 0.744498 0.742471
Echinococcus multilocularis tubulin alpha chain 0.125601 0.744498 0.743963
Trichomonas vaginalis tubulin, putative 0.0499951 0.28498 0.279305
Echinococcus multilocularis tubulin alpha chain 0.125601 0.744498 0.743963
Echinococcus granulosus family S9 non peptidase ue S09 family 0.00440208 0.00787409 0.00579705
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.00554761 0.0148364 0.0127739
Plasmodium vivax tubulin alpha chain, putative 0.125601 0.744498 0.665707
Schistosoma mansoni tyrosine kinase 0.0179014 0.0899205 0.0899205
Echinococcus granulosus tubulin alpha 0.0928459 0.545419 0.544467
Brugia malayi Tyrosine-protein kinase abl-1 0.0147435 0.0707275 0.0690768
Echinococcus granulosus neuroligin 0.00440208 0.00787409 0.00579705
Giardia lamblia Beta tubulin 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.00413073 0.00622488 0.00615855
Echinococcus multilocularis tubulin alpha chain 0.125601 0.744498 0.743963
Leishmania major beta tubulin 0.16764 1 1
Echinococcus multilocularis insulin receptor 0.010825 0.0469115 0.0449162
Echinococcus granulosus insulin receptor 0.010825 0.0469115 0.0449162
Trichomonas vaginalis tubulin beta chain, putative 0.16764 1 1
Trypanosoma cruzi tubulin delta chain 0.0909934 0.534159 0.524486
Echinococcus multilocularis integrin alpha ps 0.00793363 0.0293381 0.0273061
Trypanosoma cruzi tubulin gamma chain 0.100955 0.594703 0.586288
Echinococcus multilocularis carbonic anhydrase 0.0123616 0.0562504 0.0542746
Trypanosoma brucei epsilon tubulin 0.100824 0.593907 0.502665
Onchocerca volvulus 0.00440208 0.00787409 0.00497843
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.00554761 0.0148364 0.0127739
Echinococcus multilocularis 0.010059 0.0422558 0.0402507
Trypanosoma cruzi beta tubulin, putative 0.16764 1 1
Trypanosoma brucei alpha tubulin 0.125601 0.744498 0.687092
Echinococcus multilocularis tubulin delta chain 0.0418861 0.235695 0.234095
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Loa Loa (eye worm) hypothetical protein 0.00416914 0.0064583 0.00639199
Echinococcus multilocularis Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Brugia malayi hypothetical protein 0.0064534 0.0203416 0.0186014
Loa Loa (eye worm) tubulin alpha-3 chain 0.0746413 0.434775 0.434737
Loa Loa (eye worm) hypothetical protein 0.083715 0.489923 0.489889
Trichomonas vaginalis tubulin gamma chain, putative 0.100824 0.593907 0.590684
Brugia malayi tubulin alpha chain - mouse 0.125601 0.744498 0.744045
Loa Loa (eye worm) hypothetical protein 0.0038029 0.00423235 0.0041659
Brugia malayi hypothetical protein 0.0064534 0.0203416 0.0186014
Echinococcus multilocularis tyrosine protein kinase Srms 0.00478299 0.0101892 0.00811697
Echinococcus granulosus carbonic anhydrase 0.0123616 0.0562504 0.0542746
Echinococcus multilocularis carbonic anhydrase II 0.033292 0.183461 0.181752
Trichomonas vaginalis tubulin epsilon chain, putative 0.125601 0.744498 0.742471
Schistosoma mansoni hypothetical protein 0.0038029 0.00423235 0.00423235
Leishmania major gamma-tubulin 0.100955 0.594703 0.503641
Onchocerca volvulus 0.0064534 0.0203416 0.0488187
Brugia malayi Tubulin alpha-2 chain 0.125601 0.744498 0.744045
Schistosoma mansoni tyrosine kinase 0.024495 0.129995 0.129995
Echinococcus multilocularis integrin alpha 3 0.0152116 0.0735722 0.0716327
Schistosoma mansoni tyrosine kinase 0.0329388 0.181314 0.181314
Brugia malayi SRC-1 0.00554761 0.0148364 0.0130864
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Echinococcus multilocularis Solute carrier organic anion transporter family 0.0064534 0.0203416 0.0182907
Loa Loa (eye worm) carbonic anhydrase 3 0.033292 0.183461 0.183407
Onchocerca volvulus Putative organic anion transporter 0.0064534 0.0203416 0.0488187
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0111578 0.0489339 0.0469429
Echinococcus granulosus alpha tubulin 0.125601 0.744498 0.743963
Schistosoma mansoni integrin alpha-ps 0.00793363 0.0293381 0.0293381
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Echinococcus granulosus peroxisome assembly protein 26 0.125601 0.744498 0.743963
Loa Loa (eye worm) tubulin beta-4 chain 0.16764 1 1
Loa Loa (eye worm) tubulin beta chain 0.16764 1 1
Trichomonas vaginalis tubulin, putative 0.0509598 0.290843 0.285215
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Schistosoma mansoni tubulin subunit gamma 0.100955 0.594703 0.594703
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0509598 0.290843 0.285215
Trypanosoma cruzi epsilon tubulin, putative 0.100824 0.593907 0.585475
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Echinococcus multilocularis Tubulin beta 2C chain 0.16764 1 1
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0179014 0.0899205 0.0880152
Echinococcus granulosus tubulin alpha chain 0.125601 0.744498 0.743963
Echinococcus multilocularis neuroligin 0.00440208 0.00787409 0.00579705
Echinococcus granulosus beta tubulin 0.16764 1 1
Loa Loa (eye worm) tubulin beta-2A chain 0.16764 1 1
Trypanosoma cruzi zeta tubulin, putative 0.123659 0.732696 0.727145
Loa Loa (eye worm) TK/EGFR protein kinase 0.0329388 0.181314 0.18126
Trichomonas vaginalis tubulin epsilon chain, putative 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.00416914 0.0064583 0.00639199
Loa Loa (eye worm) hypothetical protein 0.0133862 0.0624778 0.0624152
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00478299 0.0101892 0.00811697
Giardia lamblia Alpha-tubulin 0.125601 0.744498 0.665707
Echinococcus multilocularis acetylcholinesterase 0.0260531 0.139465 0.137663
Echinococcus multilocularis tyrosine protein kinase Src42A 0.00554761 0.0148364 0.0127739
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Echinococcus granulosus fibroblast growth factor receptor 4 0.0120332 0.0542545 0.0522745
Schistosoma mansoni organic anion transporter 0.0064534 0.0203416 0.0203416
Trichomonas vaginalis tubulin alpha chain, putative 0.0509598 0.290843 0.285215
Schistosoma mansoni tyrosine kinase 0.0179014 0.0899205 0.0899205
Toxoplasma gondii tubulin, putative 0.00797797 0.0296076 0.0232998
Echinococcus granulosus tubulin subunit beta 0.16764 1 1
Echinococcus multilocularis epidermal growth factor receptor 0.0329388 0.181314 0.179601
Brugia malayi Carboxylesterase family protein 0.00440208 0.00787409 0.00611176
Brugia malayi sodium-independent organic anion transporter family protein 0.0064534 0.0203416 0.0186014
Brugia malayi Cell division protein ftsZ 0.0418861 0.235695 0.234337
Trichomonas vaginalis tubulin alpha chain, putative 0.0509598 0.290843 0.285215
Trichomonas vaginalis tubulin gamma chain, putative 0.16764 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0509598 0.290843 0.285215
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Echinococcus multilocularis carbonic anhydrase 0.0123616 0.0562504 0.0542746
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Loa Loa (eye worm) tubulin alpha chain 0.125601 0.744498 0.744481
Brugia malayi sodium-independent organic anion transporter family protein 0.0064534 0.0203416 0.0186014
Entamoeba histolytica tubulin family protein 0.16764 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0418861 0.235695 0.229629
Schistosoma mansoni hypothetical protein 0.0123616 0.0562504 0.0562504
Schistosoma mansoni tubulin subunit alpha 0.125601 0.744498 0.744498
Schistosoma mansoni hypothetical protein 0.0034821 0.00228261 0.00228261
Echinococcus granulosus tubulin alpha 3 chain 0.125601 0.744498 0.743963
Echinococcus multilocularis tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.00416914 0.0064583 0.00469346
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0418861 0.235695 0.5
Loa Loa (eye worm) hypothetical protein 0.0155394 0.0755647 0.075503
Echinococcus granulosus tubulin epsilon chain 0.100824 0.593907 0.593057
Echinococcus granulosus tubulin delta chain 0.0418861 0.235695 0.234095
Brugia malayi sodium-independent organic anion transporter family protein 0.0064534 0.0203416 0.0186014
Loa Loa (eye worm) tubulin alpha 2 0.083715 0.489923 0.489889
Leishmania major beta tubulin 0.16764 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0418861 0.235695 0.229629
Echinococcus multilocularis carboxylesterase 5A 0.0260531 0.139465 0.137663
Echinococcus multilocularis agrin 0.00416914 0.0064583 0.0043783
Echinococcus multilocularis tubulin alpha chain 0.125601 0.744498 0.743963
Onchocerca volvulus 0.0064534 0.0203416 0.0488187
Onchocerca volvulus 0.00440208 0.00787409 0.00497843
Giardia lamblia Beta tubulin 0.16764 1 1
Echinococcus granulosus BC026374 protein S09 family 0.00440208 0.00787409 0.00579705
Loa Loa (eye worm) integrin alpha pat-2 0.0289256 0.156923 0.156867
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0111578 0.0489339 0.0469429
Echinococcus granulosus para nitrobenzyl esterase 0.00440208 0.00787409 0.00579705
Trichomonas vaginalis tubulin, putative 0.16764 1 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.083715 0.489923 0.485875
Echinococcus granulosus tyrosine protein kinase ABL1 0.0252791 0.13476 0.132949
Brugia malayi Tubulin beta chain 0.0509598 0.290843 0.289583
Loa Loa (eye worm) agrin synaptic family protein 0.00416914 0.0064583 0.00639199
Treponema pallidum cell division protein FtsZ 0.0418861 0.235695 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0418861 0.235695 0.229629
Brugia malayi Kelch motif family protein 0.00550764 0.0145935 0.0128431
Schistosoma mansoni alpha tubulin 0.125601 0.744498 0.744498
Leishmania major beta tubulin 0.16764 1 1
Trypanosoma brucei alpha tubulin, putative 0.0509598 0.290843 0.131508
Loa Loa (eye worm) acetylcholinesterase 1 0.0260531 0.139465 0.139408
Leishmania major epsilon tubulin, putative 0.100824 0.593907 0.502665
Leishmania major beta tubulin 0.16764 1 1
Brugia malayi Carboxylesterase family protein 0.0260531 0.139465 0.137937
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Entamoeba histolytica tubulin family protein 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Schistosoma mansoni carbonic anhydrase-related 0.0123616 0.0562504 0.0562504
Loa Loa (eye worm) hypothetical protein 0.125601 0.744498 0.744481
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.0120332 0.0542545 0.0522745
Trypanosoma brucei tubulin delta chain 0.0909934 0.534159 0.429493
Brugia malayi tubulin alpha-2 chain 0.125601 0.744498 0.744045
Trichomonas vaginalis tubulin epsilon chain, putative 0.125601 0.744498 0.742471
Echinococcus multilocularis fibroblast growth factor receptor 4 0.0120332 0.0542545 0.0522745
Schistosoma mansoni tyrosine kinase 0.0120332 0.0542545 0.0542545
Echinococcus granulosus tubulin subunit TubB 0.125601 0.744498 0.743963
Echinococcus multilocularis Tubulin beta 2C chain 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Brugia malayi Putative carbonic anhydrase 5 precursor 0.033292 0.183461 0.182011
Echinococcus granulosus tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Echinococcus multilocularis tyrosine protein kinase Blk 0.00478299 0.0101892 0.00811697
Mycobacterium tuberculosis Cell division protein FtsZ 0.0418861 0.235695 1
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.00440208 0.00787409 0.00579705
Leishmania major beta tubulin 0.16764 1 1
Echinococcus granulosus tubulin gamma 1 chain 0.100955 0.594703 0.593855
Schistosoma mansoni tubulin subunit beta 0.0418861 0.235695 0.235695
Echinococcus multilocularis tubulin alpha chain 0.125601 0.744498 0.743963
Echinococcus multilocularis tubulin subunit TubB 0.125601 0.744498 0.743963
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0123616 0.0562504 0.054574
Echinococcus granulosus tubulin alpha 3 chain 0.125601 0.744498 0.743963
Echinococcus multilocularis hypothetical protein 0.125601 0.744498 0.743963
Onchocerca volvulus Putative organic anion transporter 0.0064534 0.0203416 0.0488187
Entamoeba histolytica tubulin alpha chain, putative 0.125601 0.744498 0.743105
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0498641 0.284183 0.27953
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.00416914 0.0064583 0.00469346
Echinococcus granulosus follistatin 0.00416914 0.0064583 0.0043783
Loa Loa (eye worm) TK protein kinase 0.00478299 0.0101892 0.0101231
Trichomonas vaginalis tubulin epsilon chain, putative 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.0260531 0.139465 0.139408
Echinococcus multilocularis tyrosine protein kinase Abl 0.0113002 0.0497993 0.04781
Schistosoma mansoni acetylcholinesterase 0.00440208 0.00787409 0.00787409
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0123616 0.0562504 0.054574
Trypanosoma brucei beta tubulin 0.0928459 0.545419 0.443282
Loa Loa (eye worm) BEN-1 protein 0.16764 1 1
Loa Loa (eye worm) tubulin alpha 2 0.083715 0.489923 0.489889
Loa Loa (eye worm) carboxylesterase 0.0260531 0.139465 0.139408
Loa Loa (eye worm) kelch domain-containing protein family protein 0.00550764 0.0145935 0.0145277
Echinococcus granulosus tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Loa Loa (eye worm) hypothetical protein 0.0123616 0.0562504 0.0561874
Brugia malayi Tubulin beta-1 chain 0.16764 1 1
Onchocerca volvulus 0.00440208 0.00787409 0.00497843
Echinococcus multilocularis beta tubulin 0.16764 1 1
Echinococcus granulosus epidermal growth factor receptor 0.0329388 0.181314 0.179601
Echinococcus granulosus Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Schistosoma mansoni tubulin subunit alpha 0.125601 0.744498 0.744498
Brugia malayi prostaglandin transporter 0.0064534 0.0203416 0.0186014
Echinococcus granulosus tubulin alpha 1C chain 0.125601 0.744498 0.743963
Echinococcus granulosus tyrosine protein kinase Src64B 0.00554761 0.0148364 0.0127739
Toxoplasma gondii beta tubulin 0.16764 1 1
Brugia malayi alpha-tubulin 0.125601 0.744498 0.744045
Loa Loa (eye worm) tubulin alpha-2 chain 0.125601 0.744498 0.744481
Brugia malayi SPARC precursor 0.00416914 0.0064583 0.00469346
Echinococcus granulosus tyrosine protein kinase Fyn 0.00554761 0.0148364 0.0127739
Brugia malayi hypothetical protein 0.00440208 0.00787409 0.00611176
Leishmania major delta tubulin, putative 0.0909934 0.534159 0.429493
Schistosoma mansoni tubulin subunit delta 0.0418861 0.235695 0.235695
Echinococcus multilocularis tubulin beta 1 chain 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Echinococcus multilocularis peroxisome assembly protein 26 0.125601 0.744498 0.743963
Loa Loa (eye worm) BEN-1 protein 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Echinococcus granulosus integrin alpha 3 0.0152116 0.0735722 0.0716327
Brugia malayi Carboxylesterase family protein 0.00440208 0.00787409 0.00611176
Echinococcus multilocularis integrin alpha ps 0.00793363 0.0293381 0.0273061
Echinococcus granulosus Tubulin beta 2C chain 0.16764 1 1
Trypanosoma cruzi epsilon tubulin, putative 0.100824 0.593907 0.585475
Onchocerca volvulus 0.0064534 0.0203416 0.0488187
Loa Loa (eye worm) hypothetical protein 0.00975145 0.0403865 0.0403225
Echinococcus granulosus tubulin alpha chain 0.125601 0.744498 0.743963
Schistosoma mansoni tyrosine kinase 0.00554761 0.0148364 0.0148364
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.033292 0.183461 0.183407
Onchocerca volvulus 0.0064534 0.0203416 0.0488187
Echinococcus granulosus tubulin beta 4A class IVa 0.16764 1 1
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0928459 0.545419 0.542464
Brugia malayi Tubulin alpha-2 chain 0.125601 0.744498 0.744045
Toxoplasma gondii beta-tubulin, putative 0.16764 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0418861 0.235695 0.229629
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0123616 0.0562504 0.054574
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.00554761 0.0148364 0.0127739
Loa Loa (eye worm) hypothetical protein 0.00416914 0.0064583 0.00639199
Loa Loa (eye worm) hypothetical protein 0.0123616 0.0562504 0.0561874
Echinococcus granulosus integrin alpha ps 0.0038029 0.00423235 0.00214769
Plasmodium falciparum alpha tubulin 1 0.125601 0.744498 0.72927
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Schistosoma mansoni tubulin subunit alpha 0.125601 0.744498 0.744498
Loa Loa (eye worm) carboxylesterase 0.00440208 0.00787409 0.00780788
Brugia malayi latrophilin 2 splice variant baaae 0.0034821 0.00228261 0.000510341
Loa Loa (eye worm) TK protein kinase 0.0039989 0.00542363 0.00535725
Brugia malayi Immunoglobulin I-set domain containing protein 0.0123769 0.0563436 0.0546674
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Loa Loa (eye worm) hypothetical protein 0.00416914 0.0064583 0.00639199
Brugia malayi Furin-like cysteine rich region family protein 0.0329388 0.181314 0.17986
Leishmania major beta tubulin 0.16764 1 1
Echinococcus multilocularis tubulin gamma 1 chain 0.100955 0.594703 0.593855
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Trypanosoma brucei zeta tubulin 0.123659 0.732696 0.672637
Leishmania major beta tubulin 0.16764 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.125601 0.744498 0.742471
Echinococcus granulosus tubulin alpha chain 0.125601 0.744498 0.743963
Schistosoma mansoni alpha tubulin 0.125601 0.744498 0.744498
Echinococcus multilocularis Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0123616 0.0562504 0.054574
Schistosoma mansoni tubulin subunit alpha 0.0418861 0.235695 0.235695
Brugia malayi Protein kinase domain containing protein 0.010825 0.0469115 0.0452185
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.033292 0.183461 0.182011
Echinococcus multilocularis tubulin alpha 3 chain 0.125601 0.744498 0.743963
Echinococcus granulosus Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.033292 0.183461 0.166507
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Brugia malayi Tubulin alpha chain 0.125601 0.744498 0.744045
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0133862 0.0624778 0.0608125
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.00478299 0.0101892 0.00811697
Onchocerca volvulus 0.00440208 0.00787409 0.00497843
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0260531 0.139465 0.139465
Schistosoma mansoni carbonic anhydrase-related 0.0123616 0.0562504 0.0562504
Giardia lamblia Beta tubulin 0.16764 1 1
Echinococcus granulosus tubulin alpha chain 0.125601 0.744498 0.743963
Trypanosoma cruzi alpha tubulin, putative 0.125601 0.744498 0.739193
Echinococcus multilocularis tyrosine protein kinase Src64B 0.00554761 0.0148364 0.0127739
Brugia malayi Calcitonin receptor-like protein seb-1 0.00509381 0.0120783 0.0103234
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Schistosoma mansoni tyrosine kinase 0.010825 0.0469115 0.0469115
Schistosoma mansoni tyrosine kinase 0.00554761 0.0148364 0.0148364
Onchocerca volvulus 0.00440208 0.00787409 0.00497843
Schistosoma mansoni neuroligin 3 (S09 family) 0.00440208 0.00787409 0.00787409
Plasmodium falciparum tubulin delta chain, putative 0.0418861 0.235695 0.19014
Schistosoma mansoni tyrosine kinase 0.0172769 0.0861249 0.0861249
Brugia malayi Tubulin gamma chain 0.100955 0.594703 0.593983
Echinococcus granulosus organic anion transporting polypeptide 30B 0.0064534 0.0203416 0.0182907
Brugia malayi Integrin alpha pat-2 precursor 0.0193423 0.098678 0.0970769
Toxoplasma gondii alpha tubulin TUBA1 0.125601 0.744498 0.742838
Loa Loa (eye worm) TK protein kinase 0.0123769 0.0563436 0.0562807
Brugia malayi Tyrosine-protein kinase abl-1 0.0113002 0.0497993 0.0481114
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0123616 0.0562504 0.054574
Trypanosoma brucei beta tubulin 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.00440208 0.00787409 0.00780788
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Leishmania major beta tubulin 0.16764 1 1
Plasmodium vivax tubulin alpha chain, putative 0.125601 0.744498 0.665707
Schistosoma mansoni alpha tubulin 0.125601 0.744498 0.744498
Loa Loa (eye worm) beta-tubulin 0.16764 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.16764 1 1
Loa Loa (eye worm) alpha-tubulin 0.125601 0.744498 0.744481
Echinococcus granulosus tyrosine kinase 0.00478299 0.0101892 0.00811697
Echinococcus granulosus tyrosine protein kinase Lyn 0.00554761 0.0148364 0.0127739
Echinococcus multilocularis expressed protein 0.00416914 0.0064583 0.0043783
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Plasmodium falciparum tubulin epsilon chain, putative 0.100824 0.593907 0.569703
Loa Loa (eye worm) hypothetical protein 0.0260531 0.139465 0.139408
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Echinococcus granulosus integrin beta 2 0.0272813 0.14693 0.145144
Trichomonas vaginalis tubulin beta chain, putative 0.0509598 0.290843 0.285215
Loa Loa (eye worm) tubulin alpha chain 0.125601 0.744498 0.744481
Plasmodium vivax tubulin epsilon chain, putative 0.100824 0.593907 0.468677
Giardia lamblia Alpha-tubulin 0.125601 0.744498 0.665707
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Echinococcus multilocularis tubulin subunit beta 0.16764 1 1
Loa Loa (eye worm) TK/INSR protein kinase 0.010825 0.0469115 0.0468479
Brugia malayi Integrin beta pat-3 precursor 0.0366767 0.204033 0.202619
Plasmodium vivax tubulin beta chain, putative 0.16764 1 1
Trypanosoma brucei alpha tubulin 0.125601 0.744498 0.687092
Giardia lamblia Epsilon tubulin 0.0498641 0.284183 0.0634414
Echinococcus multilocularis tubulin epsilon chain 0.100824 0.593907 0.593057
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.00509381 0.0120783 0.0103234
Echinococcus granulosus carbonic anhydrase II 0.033292 0.183461 0.181752
Echinococcus granulosus tyrosine protein kinase Src42A 0.00415849 0.00639358 0.00431344
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.00554761 0.0148364 0.0127739
Trypanosoma brucei zeta tubulin, putative 0.123659 0.732696 0.672637
Leishmania major alpha tubulin 0.125601 0.744498 0.687092
Trypanosoma brucei tubulin gamma chain 0.100955 0.594703 0.503641
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Loa Loa (eye worm) hypothetical protein 0.0114087 0.0504589 0.0503955
Schistosoma mansoni follistatin 0.00416914 0.0064583 0.0064583
Leishmania major beta tubulin 0.16764 1 1
Loa Loa (eye worm) hypothetical protein 0.0064534 0.0203416 0.0202762
Schistosoma mansoni integrin alpha 0.0193423 0.098678 0.098678
Trypanosoma brucei alpha tubulin 0.125601 0.744498 0.687092
Loa Loa (eye worm) hypothetical protein 0.0034821 0.00228261 0.00221602
Echinococcus multilocularis Tubulin alpha 1 chain 0.125601 0.744498 0.743963
Schistosoma mansoni tubulin subunit beta 0.16764 1 1
Onchocerca volvulus Putative organic anion transporter 0.0064534 0.0203416 0.0488187

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) = 0.2212 uM Huh7 cytotoxicity for Pf inhibitors Novartis-GNF Malaria Box. No reference
CC50 = 0.2212 uM NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7) ChEMBL. 18579783
EC50 (functional) = 0.1362 uM W2 Pf proliferation inhibition Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.1362 uM NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
EC50 (functional) = 0.2435 uM PF proliferation inhibition 3D7 Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.2435 uM NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
IFI promiscuity index = 0.15179 IFI promiscuity index Novartis-GNF Malaria Box. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 18579783

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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