Detailed information for compound 1388376

Basic information

Technical information
  • TDR Targets ID: 1388376
  • Name: MLS000048766
  • MW: 237.26 | Formula: C13H11N5
  • H donors: 0 H acceptors: 3 LogP: 3.23 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1nn2c(c1)nc(n1c2nc2c1cccc2)C
  • InChi: 1S/C13H11N5/c1-8-7-12-14-9(2)17-11-6-4-3-5-10(11)15-13(17)18(12)16-8/h3-7H,1-2H3
  • InChiKey: MDOVTGYACZMLDF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • SMR000061859
  • ZINC00535211
  • STOCK2S-65993

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Trypanosoma cruzi cysteine peptidase, putative Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania mexicana cathepsin L-like protease, 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
Brugia malayi Cathepsin L-like precursor 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
Leishmania mexicana cathepsin L-like protease, putative 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
Theileria parva cysteine 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
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
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 brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 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
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like 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
Schistosoma japonicum expressed protein 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 cathepsin L cysteine protease 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 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
Leishmania braziliensis cathepsin L-like protease 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
Trichomonas vaginalis Clan CA, family C1, papain-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
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
Leishmania major cysteine peptidase A (CPA) 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
Plasmodium yoelii berghepain-2 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
Theileria parva cysteine protease, putative 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
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like 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
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
Onchocerca volvulus 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 precursor 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
Onchocerca volvulus Cathepsin L homolog 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 l1 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
Onchocerca volvulus 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
Leishmania infantum cysteine peptidase A (CPA) Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-4 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
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana 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
Schistosoma mansoni cathepsin F (C01 family) 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
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 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
Theileria parva cysteine protease, 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 major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus granulosus cathepsin l1 Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium berghei berghepain-2 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
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
Trypanosoma brucei 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
Leishmania infantum cathepsin L-like 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-3 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
Leishmania braziliensis cysteine peptidase A (CPA) Get druggable targets OG5_126607 All targets in OG5_126607
Onchocerca volvulus 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
Theileria parva cysteine proteinase, 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
Onchocerca volvulus 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 cruzipain precursor, putative 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 brucei 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 brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 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
Echinococcus granulosus cathepsin L 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
Trypanosoma brucei 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
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 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
Neospora caninum Cathepsin L, related 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 cathepsin L cysteine protease 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
Trypanosoma cruzi cysteine peptidase, 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
Cryptosporidium hominis cryptopain 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
Leishmania infantum 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
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) hypothetical protein 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
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 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
Leishmania major cathepsin L-like protease Get druggable targets OG5_126607 All targets in OG5_126607
Theileria parva cysteine proteinase 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
Entamoeba histolytica cysteine protease, 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
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-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
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Get druggable targets OG5_126607 All targets in OG5_126607
Plasmodium knowlesi knowpain-2 Get druggable targets OG5_126607 All targets in OG5_126607
Leishmania mexicana 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
Echinococcus granulosus cathepsin l 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
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
Loa Loa (eye worm) cysteine 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
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
Loa Loa (eye worm) papain family cysteine protease containing protein 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 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 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
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
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
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
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 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
Loa Loa (eye worm) fibroinase 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
Schistosoma mansoni cathepsin F (C01 family) Get druggable targets OG5_126607 All targets in OG5_126607
Echinococcus multilocularis cysteine protease 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
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 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
Brugia malayi Cathepsin L-like cysteine proteinase 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
Toxoplasma gondii cathepsin CPL 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus cytochrome P450 2K1 0.0195 0.1739 1
Loa Loa (eye worm) fatty acid desaturase 0.0144 0.1193 0.1411
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0195 0.1739 1
Trypanosoma brucei cytochrome b5-dependent oleate desaturase 0.0144 0.1193 0.075
Loa Loa (eye worm) cytochrome P450 family protein 0.0654 0.664 0.7852
Loa Loa (eye worm) hypothetical protein 0.0119 0.0922 0.1091
Trypanosoma cruzi cytochrome P450, putative 0.0314 0.3005 0.2786
Loa Loa (eye worm) acyl-CoA desaturase 0.0824 0.8456 1
Echinococcus granulosus Fatty acid desaturase type 1 0.0144 0.1193 0.6863
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0195 0.1739 0.3012
Brugia malayi Cytochrome P450 family protein 0.0314 0.3005 0.3553
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0195 0.1739 1
Trypanosoma cruzi delta-4 fatty acid desaturase, putative 0.0145 0.12 0.0925
Leishmania major fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.075
Brugia malayi acyl-CoA desaturase 0.0824 0.8456 1
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0195 0.1739 0.3012
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0195 0.1739 0.3012
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0195 0.1739 0.1323
Schistosoma mansoni cytochrome P450 0.0195 0.1739 0.5399
Leishmania major fatty-acid desaturase, putative 0.0969 1 1
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0195 0.1739 0.3012
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0479 0.0182
Echinococcus multilocularis Peptidase M, neutral zinc metallopeptidases, zinc binding site 0.0144 0.1193 0.6863
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0195 0.1739 1
Echinococcus granulosus Sphingolipid delta4 desaturase DES1 0.0144 0.1193 0.6863
Trypanosoma brucei delta-6 fatty acid desaturase, putative 0.0144 0.1193 0.075
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0195 0.1739 0.3012
Plasmodium falciparum stearoyl-CoA desaturase 0.0824 0.8456 0.5
Loa Loa (eye worm) hypothetical protein 0.0333 0.3213 0.38
Plasmodium vivax stearoyl-CoA desaturase (acyl-CoA desaturase, faty acid desaturase), putative 0.0824 0.8456 0.5
Trypanosoma cruzi fatty acid desaturase, putative 0.0969 1 1
Loa Loa (eye worm) hypothetical protein 0.0189 0.1677 0.1983
Loa Loa (eye worm) fatty acid desaturase 0.0144 0.1193 0.1411
Mycobacterium ulcerans hypothetical protein 0.0145 0.12 0.0039
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0195 0.1739 0.3012
Trypanosoma cruzi fatty acid desaturase, putative 0.0144 0.1193 0.0918
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0195 0.1739 1
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0195 0.1739 1
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0195 0.1739 0.3012
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0314 0.3005 1
Brugia malayi Delta5 fatty acid desaturase 0.0333 0.3213 0.38
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0195 0.1739 1
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0195 0.1739 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0195 0.1739 0.148
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0195 0.1739 0.148
Brugia malayi Cytochrome P450 family protein 0.0195 0.1739 0.2056
Loa Loa (eye worm) cytochrome P450 family protein 0.0314 0.3005 0.3553
Leishmania major delta-5 fatty acid desaturase 0.0333 0.3213 0.2872
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0195 0.1739 1
Schistosoma mansoni fatty acid desaturase 0.0334 0.322 1
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0479 0.0182
Leishmania major fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.075
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0195 0.1739 1
Leishmania major fatty acid desaturase, putative 0.0144 0.1193 0.075
Mycobacterium tuberculosis Probable conserved membrane protein 0.0145 0.12 0.013
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0195 0.1739 1
Trypanosoma cruzi cruzipain precursor, putative 0.0077 0.0479 0.0182
Mycobacterium leprae Conserved hypothetical protein 0.0195 0.1739 0.5
Brugia malayi Fatty acid desaturase family protein 0.0144 0.1193 0.1411
Trypanosoma brucei sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.075
Onchocerca volvulus 0.0968 0.9993 1
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0195 0.1739 1
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0195 0.1739 0.3012
Leishmania major delta-12 fatty acid desaturase 0.0144 0.1193 0.075
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0195 0.1739 0.1323
Trypanosoma cruzi fatty acid desaturase, putative 0.0825 0.8463 0.8415
Brugia malayi cytochrome P450 0.0195 0.1739 0.2056
Trypanosoma brucei cytochrome P450, putative 0.0314 0.3005 0.2652
Brugia malayi Fatty acid desaturase family protein 0.0144 0.1193 0.1411
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0195 0.1739 1
Trypanosoma cruzi fatty acid desaturase, putative 0.0825 0.8463 0.8415
Loa Loa (eye worm) cytochrome P450 0.0195 0.1739 0.2056
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0195 0.1739 0.3012
Trypanosoma cruzi delta-4 fatty acid desaturase, putative 0.0145 0.12 0.0925
Loa Loa (eye worm) CYP4Cod1 0.0314 0.3005 0.3553
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0195 0.1739 0.3012
Trypanosoma brucei fatty acid desaturase, putative 0.0969 1 1
Leishmania major fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.075
Trypanosoma brucei delta-4 fatty acid desaturase 0.0144 0.1193 0.075
Leishmania major fatty acid desaturase, putative,sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.075
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0195 0.1739 1
Leishmania major cytochrome p450-like protein 0.0195 0.1739 0.1323
Onchocerca volvulus 0.0968 0.9993 1
Loa Loa (eye worm) FAT-3 protein 0.0333 0.3213 0.38
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.007 0.0408 0.0108
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0195 0.1739 1
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0195 0.1739 1
Echinococcus multilocularis Fatty acid desaturase, type 1 0.0144 0.1193 0.6863
Brugia malayi Cytochrome P450 family protein 0.0314 0.3005 0.3553
Trypanosoma cruzi cytochrome P450, putative 0.0314 0.3005 0.2786
Toxoplasma gondii cytochrome p450 superfamily protein 0.0195 0.1739 1
Leishmania major cytochrome p450-like protein 0.0195 0.1739 0.1323
Leishmania major fatty acid desaturase, putative 0.0144 0.1193 0.075
Echinococcus multilocularis Peptidase M, neutral zinc metallopeptidases, zinc binding site 0.0144 0.1193 0.6863
Echinococcus multilocularis 0.0195 0.1739 1
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0195 0.1739 0.3012
Schistosoma mansoni hypothetical protein 0.0195 0.1739 0.5399
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0195 0.1739 0.148
Brugia malayi Cytochrome P450 family protein 0.0654 0.664 0.7852
Loa Loa (eye worm) cytochrome P450 family protein 0.0314 0.3005 0.3553
Leishmania major cytochrome p450-like protein 0.0314 0.3005 0.2652
Leishmania major delta-6 fatty acid desaturase 0.0145 0.12 0.0757
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0195 0.1739 1
Trypanosoma cruzi fatty acid desaturase, putative 0.0144 0.1193 0.0918
Trypanosoma cruzi cytochrome b5-dependent oleate desaturase 0.0144 0.1193 0.0918
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0195 0.1739 0.3012
Mycobacterium leprae putative cytochrome p450 0.0195 0.1739 0.5
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0195 0.1739 1
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0195 0.1739 1
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0195 0.1739 1
Trypanosoma cruzi cysteine peptidase, putative 0.0077 0.0479 0.0182
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0195 0.1739 0.3012
Leishmania major delta-4 fatty acid desaturase 0.0144 0.1193 0.075
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0195 0.1739 0.3012
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0195 0.1739 0.3012
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0195 0.1739 1
Trypanosoma cruzi sphingolipid delta 4 desaturase, putative 0.0144 0.1193 0.0918
Onchocerca volvulus 0.0334 0.322 0.3223

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 6.3096 um PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] ChEMBL. No reference
Potency (functional) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS Assay for Inhibitors of the HIV-1 protein Vpr. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 uM PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 95.2834 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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