Detailed information for compound 411154

Basic information

Technical information
  • TDR Targets ID: 411154
  • Name: 2-cyano-4-(2,2-dimethylpropylamino)-N-[2-[4-[ (4-methylpiperazin-1-yl)methyl]phenyl]ethyl]p yrimidine-5-carboxamide
  • MW: 449.592 | Formula: C25H35N7O
  • H donors: 2 H acceptors: 4 LogP: 3.73 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#Cc1ncc(c(n1)NCC(C)(C)C)C(=O)NCCc1ccc(cc1)CN1CCN(CC1)C
  • InChi: 1S/C25H35N7O/c1-25(2,3)18-29-23-21(16-28-22(15-26)30-23)24(33)27-10-9-19-5-7-20(8-6-19)17-32-13-11-31(4)12-14-32/h5-8,16H,9-14,17-18H2,1-4H3,(H,27,33)(H,28,29,30)
  • InChiKey: GASCFELIQZXIAB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-cyano-4-(2,2-dimethylpropylamino)-N-[2-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]ethyl]-5-pyrimidinecarboxamide
  • 2-cyano-N-[2-[4-[(4-methylpiperazino)methyl]phenyl]ethyl]-4-(neopentylamino)pyrimidine-5-carboxamide
  • 2-cyano-N-[2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]ethyl]-4-(neopentylamino)pyrimidine-5-carboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cathepsin L Starlite/ChEMBL References
Homo sapiens cathepsin K Starlite/ChEMBL References
Homo sapiens cathepsin S 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_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus granulosus cathepsin L cysteine proteinase Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cysteine peptidase A (CPA) Get druggable targets OG5_126607 All targets in OG5_126607
Entamoeba histolytica cysteine protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Cathepsin L homolog Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania donovani cysteine peptidase A (CBA) Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cysteine peptidase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma mansoni cathepsin F (C01 family) Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Cathepsin F homolog Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cysteine peptidase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania braziliensis cysteine peptidase A (CPA) Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium vivax vivapain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) fibroinase Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cysteine protease Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium berghei berghepain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma japonicum expressed protein Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine proteinase Get druggable targets OG5_126607 All targets in OG5_126607
Entamoeba histolytica cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma japonicum ko:K01373 cathepsin F [EC3.4.22.41], putative Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cathepsin l cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus granulosus cathepsin l1 Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cruzipain precursor, putative Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Cathepsin L homolog Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Entamoeba histolytica cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cysteine protease Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cathepsin L cysteine protease Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus granulosus cathepsin l cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana cathepsin L-like protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana cysteine peptidase A (CBA) Get druggable targets OG5_126607 All targets in OG5_126607
Cryptosporidium parvum cryptopain - cysteine proteinase secreted, possible transmembrane domain near N-terminus Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania infantum cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana cathepsin L-like protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cysteine peptidase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cathepsin L cysteine protease Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like cysteine proteinase Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) papain family cysteine protease containing protein Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium vivax vivapain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma cruzi cysteine peptidase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania braziliensis cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium falciparum cysteine proteinase falcipain 2b Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Cryptosporidium hominis cryptopain precursor Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma mansoni cathepsin F (C01 family) Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania infantum cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma mansoni cathepsin F (C01 family) Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Cathepsin L-like precursor Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Entamoeba histolytica cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium falciparum cysteine proteinase falcipain 2a Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania braziliensis cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Schistosoma japonicum Cathepsin L-like proteinase precursor, putative Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cathepsin l cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania infantum cysteine peptidase A (CPA) Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) ctsf protein Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine proteinase, putative Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine protease, putative Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Brugia malayi Papain family cysteine protease containing protein Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania braziliensis cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Toxoplasma gondii cathepsin CPL Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium yoelii berghepain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium falciparum cysteine proteinase falcipain 3 Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126607 All targets in OG5_126607
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Neospora caninum Cathepsin L, related Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-3 Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Loa Loa (eye worm) cysteine protease Get druggable targets OG5_126607 All targets in OG5_126607
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-4 Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus granulosus cathepsin l1 Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus Get druggable targets OG5_126607 All targets in OG5_126607
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum cysteine proteinase falcipain 1 cathepsin L 333 aa 359 aa 30.1 %
Plasmodium falciparum cysteine proteinase falcipain 1 cathepsin S 281 aa 226 aa 34.1 %
Plasmodium falciparum cysteine proteinase falcipain 1 cathepsin K 329 aa 349 aa 33.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0157 0.8309 1
Entamoeba histolytica cysteine protease, putative 0.0081 0.3466 1
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Echinococcus granulosus cathepsin L 0.0042 0.0955 0.0633
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0033 0.0411 0.0411
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Plasmodium vivax vivapain-1 0.0042 0.0955 0.2757
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.0033 0.0411 0.0411
Loa Loa (eye worm) hypothetical protein 0.0054 0.1754 0.1946
Loa Loa (eye worm) hypothetical protein 0.0054 0.1754 0.1946
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0081 0.3466 0.3551
Plasmodium vivax unspecified product 0.0042 0.0955 0.2757
Brugia malayi cathepsin L-like precursor 0.0054 0.1754 0.1946
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0049 0.1396 0.1145
Brugia malayi Cathepsin L-like precursor 0.0054 0.1754 0.1946
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Trypanosoma cruzi cysteine proteinase, putative 0.0042 0.0955 0.2757
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0081 0.3466 0.3551
Entamoeba histolytica cysteine proteinase, putative 0.0081 0.3466 1
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0168 0.9015 1
Echinococcus multilocularis cysteine protease 0.0081 0.3466 0.3551
Brugia malayi Cathepsin L-like cysteine proteinase 0.0054 0.1754 0.1946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0042 0.0955 0.069
Trypanosoma cruzi cruzipain precursor, putative 0.0081 0.3466 1
Trypanosoma cruzi cysteine protease, putative 0.0042 0.0955 0.2757
Onchocerca volvulus 0.0081 0.3466 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Leishmania major cysteine peptidase A (CPA) 0.0081 0.3466 0.5
Loa Loa (eye worm) hypothetical protein 0.0054 0.1754 0.1946
Brugia malayi Cathepsin L-like precursor 0.0054 0.1754 0.1946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Trypanosoma cruzi cysteine peptidase, putative 0.0081 0.3466 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Loa Loa (eye worm) fibroinase 0.0081 0.3466 0.3845
Brugia malayi Papain family cysteine protease containing protein 0.0042 0.0955 0.106
Loa Loa (eye worm) hypothetical protein 0.0049 0.1396 0.1549
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0081 0.3466 0.3845
Echinococcus multilocularis voltage gated potassium channel 0.0049 0.1396 0.1145
Onchocerca volvulus 0.0081 0.3466 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Schistosoma mansoni cathepsin F (C01 family) 0.0081 0.3466 0.3466
Schistosoma mansoni cathepsin F (C01 family) 0.0054 0.1754 0.1754
Plasmodium vivax vivapain-3 0.0042 0.0955 0.2757
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0054 0.1754 0.5061
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Schistosoma mansoni voltage-gated potassium channel 0.0033 0.0411 0.0411
Loa Loa (eye worm) cysteine protease 0.0081 0.3466 0.3845
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0033 0.0411 0.0411
Loa Loa (eye worm) hypothetical protein 0.0033 0.0411 0.0456
Onchocerca volvulus 0.0081 0.3466 1
Trypanosoma cruzi cysteine peptidase, putative 0.0081 0.3466 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0042 0.0955 0.0955
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0033 0.0411 0.0411
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0081 0.3466 0.3868
Brugia malayi Papain family cysteine protease containing protein 0.0081 0.3466 0.3845
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Trypanosoma cruzi cysteine proteinase, putative 0.0042 0.0955 0.2757
Loa Loa (eye worm) hypothetical protein 0.0081 0.3466 0.3845
Onchocerca volvulus 0.0081 0.3466 1
Onchocerca volvulus 0.0081 0.3466 1
Entamoeba histolytica cysteine proteinase, putative 0.0054 0.1754 0.3182
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Schistosoma mansoni cathepsin F (C01 family) 0.0081 0.3466 0.3466
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Echinococcus multilocularis cathepsin L 0.0042 0.0955 0.0633
Plasmodium falciparum cysteine proteinase falcipain 3 0.0081 0.3466 1
Echinococcus granulosus cathepsin l1 0.0054 0.1754 0.1562
Echinococcus multilocularis cysteine protease 0.0081 0.3466 0.3551
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0168 0.9015 1
Entamoeba histolytica cysteine proteinase, putative 0.0081 0.3466 1
Trypanosoma cruzi cysteine peptidase, putative 0.0081 0.3466 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Plasmodium vivax vivapain-2 0.0081 0.3466 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Onchocerca volvulus Cathepsin L homolog 0.0081 0.3466 1
Onchocerca volvulus Cathepsin L homolog 0.0081 0.3466 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0042 0.0955 0.0955
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0049 0.1396 0.1549
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0081 0.3466 0.3845
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0168 0.9015 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0033 0.0411 0.0456
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.0033 0.0411 0.0456
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0081 0.3466 0.3868
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0081 0.3466 1
Plasmodium vivax vivapain-2 0.0081 0.3466 1
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0042 0.0955 0.2757
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0054 0.1754 0.1701
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0081 0.3466 1
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0042 0.0955 0.069
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Brugia malayi Cyclic-nucleotide gated cation channel 0.0033 0.0411 0.0456
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0081 0.3466 0.3551
Echinococcus granulosus cathepsin l1 0.0081 0.3466 0.3551
Echinococcus granulosus cathepsin L cysteine protease 0.0042 0.0955 0.0633
Schistosoma mansoni voltage-gated potassium channel 0.0183 1 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.0033 0.0411 0.0411
Echinococcus granulosus voltage gated potassium channel 0.0049 0.1396 0.1145
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0157 0.8309 1
Toxoplasma gondii cathepsin CPL 0.0081 0.3466 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Trypanosoma cruzi cysteine peptidase, putative 0.0081 0.3466 1
Loa Loa (eye worm) hypothetical protein 0.0145 0.7598 0.8429
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0054 0.1754 0.1701
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Brugia malayi Papain family cysteine protease containing protein 0.0042 0.0955 0.106
Leishmania major cathepsin L-like protease 0.0081 0.3466 0.5
Echinococcus granulosus cathepsin l cysteine peptidase 0.0081 0.3466 0.3551
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Trypanosoma cruzi cysteine peptidase, putative 0.0042 0.0955 0.2757
Brugia malayi Cathepsin L-like precursor 0.0081 0.3466 0.3845
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0049 0.1396 0.1145
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1396 0.1396
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Onchocerca volvulus 0.0081 0.3466 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0081 0.3466 1
Onchocerca volvulus 0.0081 0.3466 1
Loa Loa (eye worm) ctsf protein 0.0081 0.3466 0.3845
Onchocerca volvulus Cathepsin F homolog 0.0081 0.3466 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0042 0.0955 0.0955
Echinococcus multilocularis cathepsin L cysteine protease 0.0081 0.3466 0.3551
Echinococcus granulosus cysteine protease 0.0042 0.0955 0.0633
Echinococcus granulosus cathepsin L cysteine proteinase 0.0081 0.3466 0.3551
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0168 0.9015 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0081 0.3466 0.3868
Schistosoma mansoni voltage-gated potassium channel 0.0049 0.1396 0.1396
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0081 0.3466 0.3868

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.011 nM Inhibition of human recombinant cathepsin K ChEMBL. 17256925
IC50 (binding) = 0.011 nM Inhibition of human recombinant cathepsin K ChEMBL. 17256925
IC50 (binding) = 0.33 nM Inhibition of human recombinant cathepsin L ChEMBL. 17256925
IC50 (binding) = 0.33 nM Inhibition of human recombinant cathepsin L ChEMBL. 17256925
IC50 (binding) = 2.5 nM Inhibition of human recombinant cathepsin S ChEMBL. 17256925
IC50 (binding) = 2.5 nM Inhibition of human recombinant cathepsin S ChEMBL. 17256925

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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