Detailed information for compound 1713238

Basic information

Technical information
  • TDR Targets ID: 1713238
  • Name: 5-(4-methoxyphenyl)-1,3-di(phenyl)-4,5-dihydr opyrazole
  • MW: 328.407 | Formula: C22H20N2O
  • H donors: 0 H acceptors: 0 LogP: 4.99 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1
  • InChi: 1S/C22H20N2O/c1-25-20-14-12-18(13-15-20)22-16-21(17-8-4-2-5-9-17)23-24(22)19-10-6-3-7-11-19/h2-15,22H,16H2,1H3
  • InChiKey: GBGBZODHBDYVBP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2574-33-6
  • 5-(4-Methoxy-phenyl)-1,3-diphenyl-4,5-dihydro-1H-pyrazole
  • BAS 00119452
  • 5-(4-Methoxyphenyl)-1,3-diphenyl-2-imidazoline
  • 5-(4-Methoxyphenyl)-1,3-diphenyl-4,5-dihydro-1H-pyrazole
  • ST5217202
  • NSC409745

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Capra hircus Cathepsin H Starlite/ChEMBL References
Capra hircus Cathepsin B Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania infantum cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma brucei gambiense cysteine peptidase C (CPC), putative,CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma brucei cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania mexicana cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Toxoplasma gondii cathepsin B Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania donovani cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Leishmania braziliensis cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like Get druggable targets OG5_127800 All targets in OG5_127800
Neospora caninum Cathepsin B-like protease (Precursor), related Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus granulosus cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus granulosus cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Loa Loa (eye worm) cathepsin B Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma cruzi cysteine peptidase C (CPC), putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum ko:K01363 cathepsin B [EC3.4.22.1], putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni SmCB2 peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus multilocularis cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma cruzi cysteine peptidase C (CPC), putative Get druggable targets OG5_127800 All targets in OG5_127800
Echinococcus multilocularis cathepsin b Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma mansoni cathepsin B-like peptidase (C01 family) Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Schistosoma japonicum Cathepsin B-like cysteine proteinase precursor, putative Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Brugia malayi cathepsin B-like cysteine proteinase Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trypanosoma congolense cysteine peptidase C (CPC) Get druggable targets OG5_127800 All targets in OG5_127800
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase Get druggable targets OG5_127800 All targets in OG5_127800
Giardia lamblia Cathepsin B precursor Get druggable targets OG5_127800 All targets in OG5_127800
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium vivax dipeptidyl aminopeptidase 2, putative Cathepsin B   335 aa 286 aa 27.6 %
Dictyostelium discoideum cysteine proteinase Cathepsin H   335 aa 297 aa 38.7 %
Plasmodium falciparum serine repeat antigen 1 Cathepsin H   335 aa 287 aa 22.3 %
Plasmodium falciparum cysteine proteinase falcipain 3 Cathepsin H   335 aa 343 aa 32.9 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.5 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 296 aa 23.6 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 324 aa 34.6 %
Plasmodium yoelii berghepain-2 Cathepsin H   335 aa 318 aa 33.0 %
Leishmania mexicana Cathepsin H   335 aa 272 aa 36.4 %
Giardia lamblia Cathepsin L-like protease Cathepsin B   335 aa 284 aa 23.6 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Plasmodium vivax vivapain-3 Cathepsin B   335 aa 301 aa 23.6 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 339 aa 26.8 %
Brugia malayi Papain family cysteine protease containing protein Cathepsin H   335 aa 287 aa 34.1 %
Leishmania infantum cathepsin L-like protease Cathepsin H   335 aa 333 aa 37.2 %
Schistosoma japonicum Disco-interacting protein 2 homolog B, putative Cathepsin H   335 aa 350 aa 36.0 %
Echinococcus multilocularis cathepsin L cysteine protease Cathepsin H   335 aa 316 aa 39.2 %
Theileria parva cathepsin C, putative Cathepsin B   335 aa 291 aa 26.8 %
Cryptosporidium parvum preprocathepsin c precursor, putative Cathepsin B   335 aa 281 aa 28.1 %
Onchocerca volvulus Protein MCM10 homolog Cathepsin H   335 aa 313 aa 36.1 %
Plasmodium yoelii cathepsin c precursor Cathepsin B   335 aa 319 aa 25.7 %
Plasmodium knowlesi knowpain-1 Cathepsin B   335 aa 289 aa 21.8 %
Toxoplasma gondii cathepsin B Cathepsin H   335 aa 274 aa 26.3 %
Theileria parva cysteine proteinase, putative Cathepsin H   335 aa 334 aa 32.9 %
Onchocerca volvulus Cathepsin B-like cysteine proteinase 6 homolog Cathepsin B   335 aa 315 aa 50.2 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 271 aa 26.6 %
Cryptosporidium hominis preprocathepsin c precursor Cathepsin B   335 aa 278 aa 29.5 %
Plasmodium falciparum cysteine proteinase falcipain 1 Cathepsin B   335 aa 297 aa 22.9 %
Cryptosporidium hominis cryptopain precursor Cathepsin H   335 aa 322 aa 32.9 %
Onchocerca volvulus Cathepsin H   335 aa 325 aa 37.2 %
Echinococcus granulosus cathepsin L cysteine proteinase Cathepsin H   335 aa 321 aa 39.9 %
Giardia lamblia Cathepsin L precursor Cathepsin B   335 aa 279 aa 25.4 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 337 aa 25.8 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 322 aa 34.8 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.5 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 337 aa 25.8 %
Giardia lamblia Cathepsin L precursor Cathepsin H   335 aa 270 aa 25.2 %
Plasmodium falciparum cysteine proteinase falcipain 2a Cathepsin H   335 aa 329 aa 34.6 %
Plasmodium berghei dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 319 aa 25.7 %
Plasmodium vivax unspecified product Cathepsin B   335 aa 288 aa 21.9 %
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 332 aa 36.7 %
Schistosoma japonicum Cathepsin C precursor, putative Cathepsin B   335 aa 333 aa 26.7 %
Echinococcus multilocularis cathepsin L cysteine protease Cathepsin H   335 aa 316 aa 39.6 %
Theileria parva cysteine proteinase, putative Cathepsin H   335 aa 330 aa 26.4 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.3 %
Plasmodium berghei berghepain-2 Cathepsin H   335 aa 318 aa 33.6 %
Echinococcus multilocularis cysteine protease Cathepsin H   335 aa 316 aa 40.2 %
Entamoeba histolytica cysteine protease, putative Cathepsin B   335 aa 274 aa 21.5 %
Loa Loa (eye worm) cysteine protease Cathepsin H   335 aa 333 aa 35.1 %
Schistosoma mansoni SmCL2-like peptidase (C01 family) Cathepsin H   335 aa 315 aa 32.7 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 337 aa 27.0 %
Leishmania mexicana Cathepsin H   335 aa 333 aa 34.8 %
Echinococcus granulosus cathepsin L cysteine protease Cathepsin H   335 aa 316 aa 38.9 %
Trypanosoma cruzi cysteine peptidase, putative Cathepsin H   335 aa 319 aa 34.5 %
Leishmania mexicana cathepsin L-like protease, putative Cathepsin H   335 aa 333 aa 34.8 %
Onchocerca volvulus Cathepsin H   335 aa 328 aa 36.9 %
Dictyostelium discoideum cysteine proteinase 5 precursor Cathepsin B   335 aa 369 aa 21.4 %
Dictyostelium discoideum cysteine proteinase 1 Cathepsin B   335 aa 270 aa 25.2 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 331 aa 25.1 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 337 aa 25.8 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 322 aa 20.5 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Toxoplasma gondii preprocathepsin c precursor, putative Cathepsin B   335 aa 274 aa 24.5 %
Dictyostelium discoideum cysteine proteinase 3 Cathepsin B   335 aa 275 aa 27.6 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.0 %
Leishmania braziliensis cathepsin L-like protease Cathepsin H   335 aa 331 aa 35.3 %
Toxoplasma gondii cathepsin CPC2 Cathepsin B   335 aa 269 aa 25.3 %
Loa Loa (eye worm) ctsf protein Cathepsin H   335 aa 306 aa 36.6 %
Onchocerca volvulus Cathepsin B   335 aa 327 aa 35.2 %
Echinococcus multilocularis cathepsin L Cathepsin H   335 aa 312 aa 32.4 %
Echinococcus multilocularis cysteine protease Cathepsin H   335 aa 316 aa 40.2 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 298 aa 28.2 %
Theileria parva cysteine protease, putative Cathepsin H   335 aa 306 aa 34.0 %
Leishmania mexicana cysteine peptidase A (CBA) Cathepsin H   335 aa 308 aa 34.1 %
Leishmania mexicana cathepsin L-like protease, putative Cathepsin H   335 aa 333 aa 35.1 %
Leishmania braziliensis cathepsin L-like protease Cathepsin H   335 aa 331 aa 35.0 %
Theileria parva cysteine proteinase, putative Cathepsin B   335 aa 322 aa 23.3 %
Plasmodium berghei berghepain-1 Cathepsin B   335 aa 286 aa 22.4 %
Leishmania infantum cysteine peptidase A (CPA) Cathepsin H   335 aa 335 aa 33.7 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.4 %
Plasmodium vivax vivapain-1 Cathepsin B   335 aa 288 aa 21.9 %
Trypanosoma cruzi cysteine protease, putative Cathepsin H   335 aa 341 aa 32.3 %
Dictyostelium discoideum hypothetical protein Cathepsin H   335 aa 281 aa 27.8 %
Schistosoma mansoni cathepsin F (C01 family) Cathepsin H   335 aa 325 aa 36.9 %
Dictyostelium discoideum cysteine proteinase Cathepsin H   335 aa 292 aa 39.4 %
Neospora caninum Cathepsin L, related Cathepsin H   335 aa 291 aa 39.2 %
Onchocerca volvulus Cathepsin L homolog Cathepsin H   335 aa 325 aa 36.9 %
Leishmania mexicana Cathepsin H   335 aa 333 aa 35.1 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 308 aa 37.7 %
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) Cathepsin B   335 aa 275 aa 33.5 %
Echinococcus multilocularis cathepsin l cysteine peptidase Cathepsin H   335 aa 316 aa 39.6 %
Brugia malayi Cathepsin L-like precursor Cathepsin B   335 aa 307 aa 25.7 %
Toxoplasma gondii cathepsin CPC1 Cathepsin B   335 aa 304 aa 28.6 %
Dictyostelium discoideum cysteine protease Cathepsin B   335 aa 285 aa 24.2 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 376 aa 24.7 %
Echinococcus multilocularis cathepsin l cysteine peptidase Cathepsin H   335 aa 327 aa 44.3 %
Echinococcus granulosus cathepsin L Cathepsin H   335 aa 300 aa 41.3 %
Leishmania mexicana Cathepsin H   335 aa 333 aa 34.8 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 322 aa 35.4 %
Babesia bovis cysteine protease 2 Cathepsin H   335 aa 339 aa 31.0 %
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 297 aa 23.9 %
Schistosoma mansoni cathepsin F (C01 family) Cathepsin H   335 aa 296 aa 37.8 %
Giardia lamblia Cathepsin L precursor Cathepsin H   335 aa 282 aa 22.7 %
Plasmodium vivax vivapain-2 Cathepsin H   335 aa 327 aa 36.1 %
Schistosoma japonicum Cathepsin L-like proteinase precursor, putative Cathepsin H   335 aa 331 aa 34.4 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.5 %
Leishmania braziliensis cathepsin L-like protease Cathepsin H   335 aa 331 aa 35.0 %
Trypanosoma cruzi cysteine proteinase, putative Cathepsin B   335 aa 278 aa 26.3 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Dictyostelium discoideum cathepsin L-like proteinase Cathepsin B   335 aa 318 aa 25.5 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 322 aa 35.4 %
Plasmodium vivax vivapain-2 Cathepsin B   335 aa 309 aa 25.9 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 308 aa 25.3 %
Onchocerca volvulus Cathepsin H   335 aa 327 aa 36.4 %
Onchocerca volvulus Cathepsin H   335 aa 309 aa 36.9 %
Leishmania braziliensis cysteine peptidase A (CPA) Cathepsin H   335 aa 300 aa 33.7 %
Neospora caninum hypothetical protein Cathepsin B   335 aa 306 aa 28.1 %
Dictyostelium discoideum hypothetical protein Cathepsin H   335 aa 322 aa 31.7 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.3 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 271 aa 26.9 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 35.7 %
Leishmania donovani cysteine peptidase A (CBA) Cathepsin H   335 aa 334 aa 33.8 %
Plasmodium falciparum dipeptidyl aminopeptidase 1 Cathepsin B   335 aa 371 aa 25.3 %
Echinococcus granulosus cysteine protease Cathepsin H   335 aa 316 aa 39.2 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 27.4 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 343 aa 28.3 %
Toxoplasma gondii cathepsin CPL Cathepsin H   335 aa 311 aa 38.6 %
Cryptosporidium parvum cryptopain - cysteine proteinase secreted, possible transmembrane domain near N-terminus Cathepsin H   335 aa 322 aa 33.2 %
Entamoeba histolytica cysteine protease, putative Cathepsin B   335 aa 276 aa 23.2 %
Trypanosoma brucei gambiense cysteine peptidase precursor,cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase Cathepsin B   335 aa 286 aa 26.9 %
Babesia bovis papain family cysteine protease containing protein Cathepsin H   335 aa 311 aa 32.2 %
Echinococcus multilocularis cathepsin L Cathepsin H   335 aa 300 aa 41.7 %
Plasmodium falciparum dipeptidyl aminopeptidase 2 Cathepsin B   335 aa 302 aa 26.5 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 35.7 %
Plasmodium berghei dipeptidyl aminopeptidase 2 Cathepsin B   335 aa 315 aa 25.1 %
Theileria parva cathepsin C, putative Cathepsin B   335 aa 282 aa 29.4 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) Cathepsin B   335 aa 301 aa 27.6 %
Trypanosoma cruzi cysteine proteinase, putative Cathepsin B   335 aa 275 aa 25.8 %
Dictyostelium discoideum hypothetical protein Cathepsin H   335 aa 348 aa 38.5 %
Echinococcus granulosus cathepsin L Cathepsin H   335 aa 312 aa 32.7 %
Schistosoma mansoni cathepsin F (C01 family) Cathepsin H   335 aa 300 aa 38.3 %
Plasmodium knowlesi dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 314 aa 24.5 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Plasmodium vivax dipeptidyl aminopeptidase 1, putative Cathepsin B   335 aa 319 aa 25.1 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.5 %
Theileria parva cysteine proteinase, putative Cathepsin H   335 aa 337 aa 29.1 %
Trypanosoma cruzi cysteine peptidase, putative Cathepsin H   335 aa 332 aa 33.7 %
Giardia lamblia Dipeptidyl-peptidase I precursor Cathepsin B   335 aa 281 aa 25.6 %
Trypanosoma cruzi cruzipain precursor, putative Cathepsin H   335 aa 332 aa 33.7 %
Giardia lamblia Cathepsin L precursor Cathepsin B   335 aa 280 aa 25.4 %
Echinococcus multilocularis cathepsin b Cathepsin H   335 aa 311 aa 31.5 %
Leishmania infantum cathepsin L-like protease Cathepsin H   335 aa 324 aa 34.6 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 273 aa 26.4 %
Giardia lamblia Cathepsin B-like cysteine proteinase 3 precursor Cathepsin B   335 aa 273 aa 31.9 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 308 aa 37.0 %
Leishmania major cathepsin L-like protease Cathepsin H   335 aa 342 aa 36.3 %
Schistosoma mansoni cathepsin S (C01 family) Cathepsin H   335 aa 307 aa 30.3 %
Plasmodium knowlesi knowpain-4 Cathepsin B   335 aa 300 aa 26.0 %
Schistosoma japonicum ko:K01275 cathepsin C [EC3.4.14.1], putative Cathepsin B   335 aa 327 aa 30.9 %
Plasmodium knowlesi knowpain-3 Cathepsin H   335 aa 336 aa 35.7 %
Giardia lamblia Hypothetical protein Cathepsin B   335 aa 273 aa 32.6 %
Dictyostelium discoideum hypothetical protein Cathepsin B   335 aa 290 aa 25.9 %
Plasmodium knowlesi cysteine protease, putative Cathepsin H   335 aa 271 aa 24.7 %
Trypanosoma cruzi cysteine peptidase, putative Cathepsin H   335 aa 314 aa 34.1 %
Dictyostelium discoideum hypothetical protein Cathepsin H   335 aa 325 aa 33.5 %
Brugia malayi cathepsin B-like cysteine proteinase Cathepsin H   335 aa 342 aa 24.6 %
Drosophila melanogaster CG6347 gene product from transcript CG6347-RA Cathepsin H   335 aa 353 aa 35.7 %
Plasmodium knowlesi dipeptidyl aminopeptidase 2, putative Cathepsin B   335 aa 286 aa 28.3 %
Echinococcus granulosus cathepsin b Cathepsin H   335 aa 324 aa 29.6 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 306 aa 36.6 %
Plasmodium knowlesi knowpain-2 Cathepsin B   335 aa 304 aa 26.0 %
Plasmodium falciparum cysteine proteinase falcipain 2b Cathepsin H   335 aa 340 aa 33.2 %
Brugia malayi Cathepsin L-like precursor Cathepsin B   335 aa 307 aa 26.1 %
Theileria parva cysteine proteinase, putative Cathepsin H   335 aa 339 aa 28.3 %
Onchocerca volvulus Cathepsin B   335 aa 313 aa 23.0 %
Dictyostelium discoideum cysteine protease Cathepsin B   335 aa 283 aa 25.8 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Leishmania major cysteine peptidase A (CPA) Cathepsin H   335 aa 338 aa 33.7 %
Theileria parva cysteine proteinase, putative Cathepsin H   335 aa 316 aa 27.5 %
Plasmodium yoelii cysteine proteinase precursor Cathepsin H   335 aa 358 aa 27.7 %
Babesia bovis cathepsin C precursor, putative Cathepsin B   335 aa 307 aa 24.8 %
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin H   335 aa 325 aa 36.3 %
Trypanosoma cruzi cysteine peptidase, putative Cathepsin H   335 aa 332 aa 33.7 %
Giardia lamblia Cathepsin L-like protease Cathepsin H   335 aa 276 aa 24.6 %
Entamoeba histolytica cysteine protease, putative Cathepsin H   335 aa 314 aa 23.6 %
Drosophila melanogaster Cathepsin B1 Cathepsin H   335 aa 318 aa 26.4 %
Theileria parva cysteine proteinase Cathepsin H   335 aa 323 aa 28.2 %
Trypanosoma congolense cysteine peptidase, Clan CA, family C1, Cathepsin L-like Cathepsin B   335 aa 270 aa 26.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi hypothetical protein 0.013 0.7342 0.7342
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0171 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.006 0.2688 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0076 0.0076
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0076 0.0284
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0076 0.0076
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0076 0.0076
Echinococcus multilocularis cathepsin b 0.0171 1 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0076 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0171 1 1
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0171 1 1
Echinococcus granulosus cathepsin b 0.0171 1 1
Loa Loa (eye worm) hypothetical protein 0.013 0.7342 0.7342
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0076 0.0076
Giardia lamblia Cathepsin B precursor 0.006 0.2688 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0076 0.5
Loa Loa (eye worm) hypothetical protein 0.013 0.7342 0.7342
Onchocerca volvulus Huntingtin homolog 0.013 0.7342 1
Toxoplasma gondii exonuclease III APE 0.002 0.0076 0.0284
Loa Loa (eye worm) cathepsin B 0.006 0.2688 0.2688
Schistosoma mansoni ap endonuclease 0.002 0.0076 0.0076
Toxoplasma gondii cathepsin B 0.006 0.2688 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0076 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0076 0.0076
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.006 0.2688 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0076 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0171 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0171 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.006 0.2688 0.2688
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0076 0.0076
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0076 0.0284
Trypanosoma brucei cysteine peptidase C (CPC) 0.006 0.2688 1
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0076 0.0284
Echinococcus granulosus cathepsin b 0.0171 1 1
Schistosoma mansoni ap endonuclease 0.002 0.0076 0.0076
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0076 0.5
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0076 1
Echinococcus multilocularis cathepsin b 0.0171 1 1
Giardia lamblia Cathepsin B precursor 0.006 0.2688 1
Giardia lamblia Cathepsin B precursor 0.006 0.2688 1
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0076 0.0284
Onchocerca volvulus Huntingtin homolog 0.013 0.7342 1
Loa Loa (eye worm) hypothetical protein 0.0171 1 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.006 0.2688 0.2688
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0076 0.5

Activities

Activity type Activity value Assay description Source Reference
Activity (binding) = 1.15 nmol/min/ml Inhibition of goat liver cathepsin H assessed as enzyme activity at 10 uM using BANA substrate pre-incubated 30 mins before substrate addition by colorimetry (Rvb = 3.70 +/- 0.0387 nmol/min/ml) ChEMBL. 24913985
Activity (binding) = 1.3 nmol/min/ml Inhibition of goat liver cathepsin B assessed as enzyme activity at 10 uM using BANA substrate pre-incubated 30 mins before substrate addition by colorimetry (Rvb = 5.65 +/- 0.0276 nmol/min/ml) ChEMBL. 24913985
EC50 (functional) 20 uM PubChem BioAssay. High-throughput multiplex microsphere dose response for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, compounds from Powder Set 01. (Class of assay: confirmatory) ChEMBL. No reference
EC50 (functional) 20 uM PubChem BioAssay. High-throughput multiplex microsphere dose response for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, compounds from Powder Set 01. (Class of assay: confirmatory) ChEMBL. No reference
EC50 (functional) 20 uM PubChem BioAssay. High-throughput multiplex microsphere dose response for inhibitors of toxin protease, specifically Lethal Factor protease, compounds from Powder Set 01. (Class of assay: confirmatory) ChEMBL. No reference
Ki (binding) = 1.311 uM Competitive inhibition of goat liver cathepsin B using BANA substrate by Lineweaver-Burk plot analysis ChEMBL. 24913985
Ki (binding) = 2.119 uM Competitive inhibition of goat liver cathepsin H using Leu-betaNA substrate by Lineweaver-Burk plot analysis ChEMBL. 24913985

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

No literature references available for this target.

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