Detailed information for compound 1044182

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 471.828 | Formula: C18H20ClF6N5O
  • H donors: 1 H acceptors: 3 LogP: 2.43 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC1N(CCn2c1nnc2C(F)(F)F)C(=O)C[C@@H](Cc1cc(F)c(cc1F)F)N.Cl
  • InChi: 1S/C18H19F6N5O.ClH/c1-2-14-16-26-27-17(18(22,23)24)29(16)4-3-28(14)15(30)7-10(25)5-9-6-12(20)13(21)8-11(9)19;/h6,8,10,14H,2-5,7,25H2,1H3;1H/t10-,14?;/m1./s1
  • InChiKey: IISVEMRUXSLANN-WXGKZINCSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens dipeptidyl-peptidase 8 Starlite/ChEMBL References
Homo sapiens X-prolyl aminopeptidase (aminopeptidase P) 1, soluble Starlite/ChEMBL References
Homo sapiens dipeptidyl-peptidase 4 Starlite/ChEMBL References
Homo sapiens fibroblast activation protein, alpha Starlite/ChEMBL References
Homo sapiens peptidase D Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trypanosoma cruzi aminopeptidase P1, putative Get druggable targets OG5_127189 All targets in OG5_127189
Plasmodium vivax peptidase, putative Get druggable targets OG5_127189 All targets in OG5_127189
Schistosoma japonicum ko:K01262 X-Pro aminopeptidase [EC3.4.11.9], putative Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania braziliensis dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) Get druggable targets OG5_129743 All targets in OG5_129743
Echinococcus granulosus xaa Pro dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Plasmodium yoelii Arabidopsis thaliana At3g05350/T12H1_32 Get druggable targets OG5_127189 All targets in OG5_127189
Entamoeba histolytica hypothetical protein, conserved Get druggable targets OG5_126673 All targets in OG5_126673
Schistosoma japonicum ko:K01278 dipeptidyl-peptidase 4, putative Get druggable targets OG5_128614 All targets in OG5_128614
Schistosoma japonicum ko:K08656 dipeptidyl-peptidase 9, putative Get druggable targets OG5_129743 All targets in OG5_129743
Schistosoma japonicum Xaa-Pro aminopeptidase 1, putative Get druggable targets OG5_127189 All targets in OG5_127189
Mycobacterium tuberculosis Dipeptidase PepE Get druggable targets OG5_126673 All targets in OG5_126673
Brugia malayi prolyl oligopeptidase family protein Get druggable targets OG5_128614 All targets in OG5_128614
Cryptosporidium parvum aminopeptidase Get druggable targets OG5_127189 All targets in OG5_127189
Candida albicans similar to X-prolyl aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania mexicana dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Candida albicans similar to X-prolyl aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Cryptosporidium hominis aminopeptidase Get druggable targets OG5_127189 All targets in OG5_127189
Plasmodium falciparum aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Onchocerca volvulus Get druggable targets OG5_127189 All targets in OG5_127189
Trypanosoma brucei metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania braziliensis aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Plasmodium berghei aminopeptidase P, putative Get druggable targets OG5_127189 All targets in OG5_127189
Candida albicans dipeptidyl aminopeptidase B Get druggable targets OG5_128614 All targets in OG5_128614
Entamoeba histolytica Xaa-Pro dipeptidase, putative Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma brucei gambiense aminopeptidase P, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Neospora caninum Peptidase M24, related Get druggable targets OG5_127189 All targets in OG5_127189
Mycobacterium leprae Probable cytoplasmic peptidase PepQ Get druggable targets OG5_126673 All targets in OG5_126673
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog Get druggable targets OG5_128614 All targets in OG5_128614
Leishmania major aminopeptidase P, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus granulosus Dipeptidyl peptidase 9 Get druggable targets OG5_129743 All targets in OG5_129743
Candida albicans aminopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126673 All targets in OG5_126673
Toxoplasma gondii creatinase domain-containing protein Get druggable targets OG5_127189 All targets in OG5_127189
Trypanosoma brucei gambiense dipeptidyl-peptidase 8-like serine protease Get druggable targets OG5_129743 All targets in OG5_129743
Mycobacterium ulcerans aminopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania major aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_129743 All targets in OG5_129743
Trypanosoma brucei gambiense aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24, putative Get druggable targets OG5_127189 All targets in OG5_127189
Brugia malayi Aminopeptidase P, N-terminal domain containing protein Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania infantum aminopeptidase P, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania major aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Theileria parva peptidase, putative Get druggable targets OG5_127189 All targets in OG5_127189
Echinococcus multilocularis Dipeptidyl peptidase 9 Get druggable targets OG5_129743 All targets in OG5_129743
Trypanosoma cruzi aminopeptidase P, putative Get druggable targets OG5_126673 All targets in OG5_126673
Onchocerca volvulus Dipeptidase C homolog Get druggable targets OG5_126673 All targets in OG5_126673
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) Get druggable targets OG5_128614 All targets in OG5_128614
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Entamoeba histolytica aminopeptidase, putative Get druggable targets OG5_127189 All targets in OG5_127189
Trypanosoma brucei Xaa-Pro aminopeptidase, putative Get druggable targets OG5_127189 All targets in OG5_127189
Candida albicans similar to X-prolyl aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania mexicana aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Schistosoma japonicum ko:K01271 X-Pro dipeptidase [EC3.4.13.9], putative Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania braziliensis aminopeptidase P, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Mycobacterium ulcerans dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Brugia malayi metallopeptidase family M24 containing protein Get druggable targets OG5_127189 All targets in OG5_127189
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Loa Loa (eye worm) prolyl oligopeptidase Get druggable targets OG5_128614 All targets in OG5_128614
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative Get druggable targets OG5_129743 All targets in OG5_129743
Brugia malayi prolyl oligopeptidase family protein Get druggable targets OG5_129743 All targets in OG5_129743
Babesia bovis metallopeptidase M24 family protein Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania donovani serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Leishmania infantum aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Mycobacterium tuberculosis Probable cytoplasmic peptidase PepQ Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus granulosus Xaa Pro aminopeptidase 3 Get druggable targets OG5_126673 All targets in OG5_126673
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Wolbachia endosymbiont of Brugia malayi Xaa-Pro aminopeptidase Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania braziliensis aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania infantum dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Candida albicans aminopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Candida albicans potential metallopeptidase, similar to S. cerevisiae YFR006W Get druggable targets OG5_126673 All targets in OG5_126673
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma cruzi aminopeptidase P, putative Get druggable targets OG5_126673 All targets in OG5_126673
Mycobacterium ulcerans dipeptidase PepE Get druggable targets OG5_126673 All targets in OG5_126673
Treponema pallidum aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Leishmania infantum aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_127189 All targets in OG5_127189
Candida albicans similar to mammalian bradykinin-degrading enzyme X-prolyl aminopeptidase P Get druggable targets OG5_127189 All targets in OG5_127189
Trypanosoma cruzi metallo-peptidase, Clan MG, Family M24, putative Get druggable targets OG5_126673 All targets in OG5_126673
Giardia lamblia Xaa-Pro dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus multilocularis xaa pro aminopeptidase Get druggable targets OG5_127189 All targets in OG5_127189
Echinococcus multilocularis xaa Pro dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Chlamydia trachomatis aminopeptidase P Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma congolense Xaa-Pro aminopeptidase, putative Get druggable targets OG5_127189 All targets in OG5_127189
Echinococcus granulosus xaa Pro dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127189 All targets in OG5_127189
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126673 All targets in OG5_126673
Schistosoma mansoni aminopeptidase P1 (M24 family) Get druggable targets OG5_127189 All targets in OG5_127189
Schistosoma mansoni Xaa-Pro dipeptidase (M24 family) Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus granulosus xaa pro aminopeptidase Get druggable targets OG5_127189 All targets in OG5_127189
Echinococcus multilocularis xaa Pro dipeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma congolense metallo-peptidase, Clan MG, Family M24 Get druggable targets OG5_126673 All targets in OG5_126673
Neospora caninum prolidase, putative Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma brucei serine peptidase, Clan SC, Family S9B Get druggable targets OG5_129743 All targets in OG5_129743
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase Get druggable targets OG5_129743 All targets in OG5_129743
Mycobacterium ulcerans cytoplasmic peptidase PepQ Get druggable targets OG5_126673 All targets in OG5_126673
Brugia malayi metallopeptidase family M24 containing protein Get druggable targets OG5_126673 All targets in OG5_126673
Plasmodium knowlesi aminopeptidase P, putative Get druggable targets OG5_127189 All targets in OG5_127189
Echinococcus multilocularis Xaa Pro aminopeptidase 3 Get druggable targets OG5_126673 All targets in OG5_126673
Trypanosoma cruzi metallo-peptidase, Clan MG, Family M24, putative Get druggable targets OG5_127189 All targets in OG5_127189
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein Get druggable targets OG5_128614 All targets in OG5_128614
Toxoplasma gondii peptidase D, putative Get druggable targets OG5_126673 All targets in OG5_126673
Echinococcus granulosus dipeptidyl aminopeptidaseprotein Get druggable targets OG5_128614 All targets in OG5_128614
Leishmania mexicana aminopeptidase P, putative Get druggable targets OG5_126673 All targets in OG5_126673
Candida albicans dipeptidyl aminopeptidase B Get druggable targets OG5_128614 All targets in OG5_128614
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase Get druggable targets OG5_126673 All targets in OG5_126673
Leishmania donovani aminopeptidase P, putative Get druggable targets OG5_126673 All targets in OG5_126673
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus multilocularis Dipeptidyl peptidase 9 fibroblast activation protein, alpha 735 aa 597 aa 24.5 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0811 0.0811
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0041 0.0271 0.0199
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Giardia lamblia Alanyl dipeptidyl peptidase 0.005 0.0471 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0041 0.0271 0.053
Mycobacterium tuberculosis Probable cytoplasmic peptidase PepQ 0.0033 0.0104 0.0041
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.1225
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0811 0.0811
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Echinococcus multilocularis xaa pro aminopeptidase 0.006 0.0688 0.0688
Brugia malayi jmjC domain containing protein 0.0068 0.0877 0.0815
Schistosoma mansoni jumonji/arid domain-containing protein 0.0068 0.0877 0.0837
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0152 0.2694 0.4802
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0031 0.0067 0.0067
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Loa Loa (eye worm) hypothetical protein 0.0039 0.0235 0.0235
Schistosoma mansoni hypothetical protein 0.0039 0.0235 0.0192
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0213 0.0213
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0278 0.543 1
Schistosoma mansoni fructose-16-bisphosphatase-related 0.0152 0.2694 0.2662
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0039 0.0247 0.0341
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0057 0.0625 0.0562
Toxoplasma gondii fructose-bisphospatase I 0.0057 0.062 0.1192
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.1403 0.1403
Entamoeba histolytica dipeptidyl-peptidase, putative 0.005 0.0471 0.4733
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.1225
Toxoplasma gondii prolyl endopeptidase 0.005 0.0471 0.0802
Schistosoma mansoni ap endonuclease 0.0041 0.0271 0.0228
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0247 0.0205
Loa Loa (eye worm) hypothetical protein 0.0057 0.0625 0.0625
Onchocerca volvulus 0.0039 0.0247 0.0144
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0213 0.0213
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0489 1 1
Entamoeba histolytica prolyl oligopeptidase family protein 0.005 0.0471 0.4733
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0039 0.0247 0.0341
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.1403 0.1403
Schistosoma mansoni hypothetical protein 0.0168 0.3035 0.3005
Plasmodium falciparum peptidase, putative 0.005 0.0471 0.4806
Trypanosoma cruzi aminopeptidase P1, putative 0.006 0.0688 0.0991
Entamoeba histolytica hypothetical protein 0.0041 0.0282 0.1794
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0247 0.0162
Entamoeba histolytica hypothetical protein, conserved 0.005 0.0471 0.4733
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Echinococcus granulosus prolyl endopeptidase 0.005 0.0471 0.0471
Schistosoma mansoni ap endonuclease 0.0041 0.0271 0.0228
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0041 0.0271 0.1626
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Trichomonas vaginalis Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase 0.005 0.0471 0.0608
Mycobacterium tuberculosis Conserved protein 0.0039 0.0247 0.0341
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.1403 0.1403
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0247 0.0162
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0041 0.0271 0.0271
Echinococcus granulosus lamin dm0 0.0058 0.0652 0.0652
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.005 0.0471 0.043
Loa Loa (eye worm) hypothetical protein 0.0161 0.2892 0.2892
Brugia malayi hypothetical protein 0.0041 0.0282 0.0216
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.1403 0.1366
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0041 0.0282 0.0282
Trichomonas vaginalis conserved hypothetical protein 0.005 0.0471 0.0608
Toxoplasma gondii creatinase domain-containing protein 0.006 0.0688 0.1372
Echinococcus multilocularis lamin dm0 0.0058 0.0652 0.0652
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0267 0.5187 0.5154
Mycobacterium leprae PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B) 0.005 0.0471 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0039 0.0247 0.0247
Brugia malayi exodeoxyribonuclease III family protein 0.0041 0.0271 0.0205
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0811 0.0811
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0041 0.0282 0.0282
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0278 0.543 1
Trypanosoma brucei serine peptidase, clan SC, family S9A-like protein 0.005 0.0471 0.058
Loa Loa (eye worm) jmjC domain-containing protein 0.0068 0.0877 0.0877
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0041 0.0271 0.201
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.0811 1
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Mycobacterium tuberculosis Probable peptidase 0.005 0.0471 0.0809
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Brugia malayi Intermediate filament tail domain containing protein 0.0058 0.0652 0.0589
Trypanosoma cruzi oligopeptidase B-like protein, putative 0.005 0.0471 0.058
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.1403 0.1366
Toxoplasma gondii ABC1 family protein 0.0039 0.0247 0.0214
Trypanosoma brucei fructose-1,6-bisphosphatase 0.0152 0.2694 0.4802
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Mycobacterium leprae conserved hypothetical protein 0.0039 0.0247 0.4211
Mycobacterium ulcerans protease II (oligopeptidase B), PtrB 0.005 0.0471 1
Echinococcus granulosus xaa pro aminopeptidase 0.006 0.0688 0.0688
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.3399 0.6439
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.005 0.0471 0.043
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0811 0.1225
Schistosoma mansoni inositol monophosphatase 0.0036 0.0166 0.0123
Echinococcus multilocularis lysine specific demethylase 5A 0.0068 0.0877 0.0877
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0036 0.0166 0.1675
Onchocerca volvulus 0.0058 0.0652 0.0554
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0041 0.0271 0.0199
Loa Loa (eye worm) hypothetical protein 0.0043 0.0335 0.0335
Loa Loa (eye worm) hypothetical protein 0.0058 0.0652 0.0652
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0068 0.0877 0.0877
Trypanosoma brucei sedoheptulose-1,7-bisphosphatase 0.0057 0.062 0.0862
Brugia malayi Inositol-1 0.0036 0.0166 0.01
Echinococcus multilocularis fructose 1,6 bisphosphatase 1 0.0152 0.2694 0.2694
Leishmania major prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative 0.005 0.0471 0.058
Mycobacterium ulcerans beta-lactamase 0.0039 0.0247 0.39
Chlamydia trachomatis aminopeptidase P 0.0033 0.0104 0.5
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0278 0.543 0.543
Echinococcus granulosus tumor protein p63 0.0385 0.7752 0.7752
Mycobacterium ulcerans lipase LipD 0.0039 0.0247 0.39
Mycobacterium tuberculosis Probable lipase LipE 0.0039 0.0247 0.0341
Loa Loa (eye worm) prolyl oligopeptidase 0.005 0.0471 0.0471
Echinococcus multilocularis inositol monophosphatase 1 0.0036 0.0166 0.0166
Loa Loa (eye worm) beta-lactamase 0.0039 0.0247 0.0247
Mycobacterium tuberculosis Dipeptidase PepE 0.0033 0.0104 0.0041
Mycobacterium tuberculosis Probable esterase LipL 0.0039 0.0247 0.0341
Plasmodium vivax hypothetical protein, conserved 0.005 0.0471 0.5081
Entamoeba histolytica hypothetical protein, conserved 0.006 0.0688 0.809
Entamoeba histolytica prolyl oligopeptidase family protein 0.005 0.0471 0.4733
Toxoplasma gondii fructose-bisphospatase II 0.0152 0.2694 0.6643
Brugia malayi Calcitonin receptor-like protein seb-1 0.0057 0.0625 0.0562
Echinococcus multilocularis geminin 0.0168 0.3035 0.3035
Mycobacterium tuberculosis Conserved protein 0.0039 0.0247 0.0341
Onchocerca volvulus 0.0039 0.0247 0.0144
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0811 0.0749
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.005 0.0471 0.043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.1403 0.1366
Leishmania major aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 0.0043 0.0335 0.0321
Mycobacterium leprae Probable lipase LipE 0.0039 0.0247 0.4211
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0278 0.543 1
Onchocerca volvulus Glucosylceramidase homolog 0.0175 0.3194 0.3122
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0039 0.0247 0.39
Echinococcus multilocularis tumor protein p63 0.0385 0.7752 0.7752
Trypanosoma brucei Xaa-Pro aminopeptidase, putative 0.006 0.0688 0.0991
Trichomonas vaginalis esterase, putative 0.0039 0.0247 0.0162
Brugia malayi jmjC domain containing protein 0.0068 0.0877 0.0815
Echinococcus granulosus intermediate filament protein 0.0058 0.0652 0.0652
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.1403 0.1345
Leishmania major oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein 0.005 0.0471 0.058
Brugia malayi prolyl oligopeptidase family protein 0.005 0.0471 0.0407
Brugia malayi beta-lactamase family protein 0.0039 0.0247 0.0182
Schistosoma mansoni lamin 0.0058 0.0652 0.0612
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0057 0.062 0.0862
Brugia malayi intermediate filament protein 0.0058 0.0652 0.0589
Entamoeba histolytica hypothetical protein 0.0041 0.0282 0.1794
Mycobacterium tuberculosis Probable protease II PtrBb [second part] (oligopeptidase B) 0.005 0.0471 0.0809
Trypanosoma brucei oligopeptidase b 0.005 0.0471 0.058
Brugia malayi prolyl oligopeptidase family protein 0.0278 0.543 0.54
Mycobacterium tuberculosis Probable hydrolase 0.0039 0.0247 0.0341
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0039 0.0247 0.0182
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0039 0.0247 0.0247
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0247 0.0155
Trichomonas vaginalis ap endonuclease, putative 0.0041 0.0271 0.0209
Schistosoma mansoni jumonji/arid domain-containing protein 0.0068 0.0877 0.0837
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0489 1 1
Trypanosoma cruzi oligopeptidase b 0.005 0.0471 0.058
Toxoplasma gondii sedoheptulose-1,7-bisphosphatase 0.0057 0.062 0.1192
Echinococcus granulosus acylamino acid releasing enzyme 0.005 0.0471 0.0471
Mycobacterium tuberculosis Probable lipase LipD 0.0039 0.0247 0.0341
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0247 0.0162
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0247 0.0205
Entamoeba histolytica aminopeptidase, putative 0.006 0.0688 0.8091
Echinococcus granulosus fructose 16 bisphosphatase 1 0.0152 0.2694 0.2694
Trypanosoma cruzi prolyl endopeptidase 0.005 0.0471 0.058
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0041 0.0271 0.4536
Mycobacterium leprae Probable cytoplasmic peptidase PepQ 0.0033 0.0104 0.051
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Treponema pallidum aminopeptidase P 0.006 0.0688 1
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Toxoplasma gondii acylaminoacyl-peptidase, putative 0.005 0.0471 0.0802
Trichomonas vaginalis ap endonuclease, putative 0.0041 0.0271 0.0209
Brugia malayi beta-lactamase 0.0039 0.0247 0.0182
Schistosoma mansoni intermediate filament proteins 0.0058 0.0652 0.0612
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.005 0.0471 0.043
Loa Loa (eye worm) hypothetical protein 0.005 0.0471 0.0471
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0041 0.0271 0.039
Plasmodium falciparum aminopeptidase P 0.006 0.0688 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0489 1 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0629 0.0629
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0278 0.543 0.541
Echinococcus granulosus Dipeptidyl peptidase 9 0.0278 0.543 0.543
Schistosoma mansoni inositol monophosphatase 0.0036 0.0166 0.0123
Leishmania major aminopeptidase P1, putative,metallo-peptidase, Clan MG, Family M24 0.006 0.0688 0.0991
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.1403 0.1403
Echinococcus multilocularis prolyl endopeptidase 0.005 0.0471 0.0471
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.1403 0.1403
Echinococcus granulosus lamin 0.0058 0.0652 0.0652
Trypanosoma cruzi serine peptidase, clan SC, family S9A-like protein, putative 0.005 0.0471 0.058
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0039 0.0247 0.0341
Trypanosoma brucei hypothetical protein, conserved 0.0039 0.0247 0.0155
Toxoplasma gondii exonuclease III APE 0.0041 0.0271 0.0276
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0278 0.543 1
Entamoeba histolytica hypothetical protein 0.0041 0.0282 0.1794
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0252 0.486 1
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0489 1 1
Wolbachia endosymbiont of Brugia malayi Xaa-Pro aminopeptidase 0.006 0.0688 1
Onchocerca volvulus 0.0058 0.0652 0.0554
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0267 0.5187 0.5187
Brugia malayi prolyl oligopeptidase family protein 0.005 0.0471 0.0407
Leishmania major hypothetical protein, conserved 0.0039 0.0247 0.0155
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.005 0.0471 0.0608
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0247 0.0162
Giardia lamblia Alanyl dipeptidyl peptidase 0.005 0.0471 1
Mycobacterium ulcerans esterase/lipase LipP 0.0039 0.0247 0.39
Echinococcus multilocularis lamin 0.0058 0.0652 0.0652
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0489 1 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0811 0.0771
Trypanosoma brucei prolyl endopeptidase 0.005 0.0471 0.058
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0041 0.0271 0.0271
Schistosoma mansoni hypothetical protein 0.0041 0.0282 0.0239
Trypanosoma brucei prolyl oligopeptidase, putative 0.005 0.0471 0.058
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0247 0.0162
Schistosoma mansoni hypothetical protein 0.0168 0.3035 0.3005
Schistosoma mansoni cellular tumor antigen P53 0.0056 0.0615 0.0574
Loa Loa (eye worm) hypothetical protein 0.005 0.0471 0.0471
Trichomonas vaginalis glucosylceramidase, putative 0.0175 0.3194 0.6031
Entamoeba histolytica hypothetical protein 0.0041 0.0282 0.1794
Leishmania major oligopeptidase b 0.005 0.0471 0.058
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0278 0.543 1
Brugia malayi prolyl oligopeptidase family protein 0.005 0.0471 0.0407
Echinococcus granulosus lysine specific demethylase 5A 0.0068 0.0877 0.0877
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0152 0.2694 0.4802
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0041 0.0271 0.0199
Schistosoma mansoni jumonji domain containing protein 0.0068 0.0877 0.0837
Trypanosoma brucei Alpha/beta hydrolase domain-containing protein 0.005 0.0471 0.058
Loa Loa (eye worm) hypothetical protein 0.0056 0.0615 0.0615
Brugia malayi hypothetical protein 0.0161 0.2892 0.2844
Plasmodium vivax peptidase, putative 0.006 0.0688 1
Leishmania major 0.0152 0.2694 0.4802
Onchocerca volvulus 0.0056 0.0615 0.0516
Schistosoma mansoni lamin 0.0058 0.0652 0.0612
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.193 0.193
Schistosoma mansoni transcription factor LCR-F1 0.0041 0.0282 0.0239
Entamoeba histolytica dipeptidyl-peptidase, putative 0.005 0.0471 0.4733
Echinococcus granulosus inositol monophosphatase 1 0.0036 0.0166 0.0166
Loa Loa (eye worm) hypothetical protein 0.0039 0.0247 0.0247
Echinococcus multilocularis beta LACTamase domain containing family member 0.0039 0.0247 0.0247
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0247 0.0155
Trypanosoma cruzi metallo-peptidase, Clan MG, Family M24, putative 0.006 0.0688 0.0991
Echinococcus multilocularis musashi 0.0058 0.0652 0.0652
Echinococcus multilocularis acylamino acid releasing enzyme 0.005 0.0471 0.0471
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0058 0.0652 0.0652
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0041 0.0271 0.0199
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0235 0.0169
Trypanosoma cruzi oligopeptidase b 0.005 0.0471 0.058
Brugia malayi fructose-1,6-bisphosphatase 0.0152 0.2694 0.2645
Brugia malayi metallopeptidase family M24 containing protein 0.006 0.0688 0.0625
Mycobacterium tuberculosis Conserved protein 0.0039 0.0247 0.0341
Mycobacterium ulcerans hypothetical protein 0.0039 0.0247 0.39
Loa Loa (eye worm) intermediate filament protein 0.0058 0.0652 0.0652
Trichomonas vaginalis glucosylceramidase, putative 0.0267 0.5187 1
Trypanosoma cruzi hypothetical protein, conserved 0.005 0.0471 0.058
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0811 0.1225
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0041 0.0271 0.0271
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0057 0.062 0.0862
Trypanosoma cruzi hypothetical protein, conserved 0.005 0.0471 0.058
Entamoeba histolytica prolyl oligopeptidase family protein 0.005 0.0471 0.4733
Loa Loa (eye worm) inositol-1 0.0036 0.0166 0.0166
Toxoplasma gondii hypothetical protein 0.005 0.0471 0.0802
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0057 0.0625 0.0625
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0068 0.0877 0.0877
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.3399 0.6439
Loa Loa (eye worm) fructose-1,6-bisphosphatase 0.0152 0.2694 0.2694
Onchocerca volvulus Prolyl endopeptidase homolog 0.005 0.0471 0.0371
Echinococcus granulosus geminin 0.0168 0.3035 0.3035
Brugia malayi beta-lactamase family protein 0.0039 0.0247 0.0182
Onchocerca volvulus 0.0039 0.0247 0.0144
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0211 0.3972 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 5 nM Inhibition of DPP4 (unknown origin) ChEMBL. 18201067
IC50 (binding) = 113 nM Inhibition of DPP4 (unknown origin) ChEMBL. 18201067
IC50 (binding) = 8000 nM Inhibition of DPP8 (unknown origin) ChEMBL. 18201067
IC50 (binding) > 10000 nM Inhibition of amino peptidase P (unknown origin) ChEMBL. 18201067
IC50 (binding) > 10000 nM Inhibition of prolidase (unknown origin) ChEMBL. 18201067
IC50 (binding) > 10000 nM Inhibition of FAP (unknown origin) ChEMBL. 18201067
IC50 (binding) = 47000 nM Inhibition of QPP (unknown origin) ChEMBL. 18201067
IC50 (binding) > 100000 nM Inhibition of QPP (unknown origin) ChEMBL. 18201067
IC50 (binding) > 100000 nM Inhibition of DPP8 (unknown origin) ChEMBL. 18201067
IC50 (binding) > 100000 nM Inhibition of DPP9 (unknown origin) ChEMBL. 18201067

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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