Detailed information for compound 1108811

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 383.39 | Formula: C13H20F3N5O3S
  • H donors: 3 H acceptors: 4 LogP: -1.86 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C(F)(F)F.N#C[C@@H]1CSCN1C(=O)CN(C1CCNCC1)N
  • InChi: 1S/C11H19N5OS.C2HF3O2/c12-5-10-7-18-8-15(10)11(17)6-16(13)9-1-3-14-4-2-9;3-2(4,5)1(6)7/h9-10,14H,1-4,6-8,13H2;(H,6,7)/t10-;/m1./s1
  • InChiKey: JNRGYKKRDUWEKO-HNCPQSOCSA-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
Sus scrofa Dipeptidyl peptidase IV Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) Get druggable targets OG5_128614 All targets in OG5_128614
Candida albicans dipeptidyl aminopeptidase B Get druggable targets OG5_128614 All targets in OG5_128614
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog Get druggable targets OG5_128614 All targets in OG5_128614
Brugia malayi prolyl oligopeptidase family protein Get druggable targets OG5_128614 All targets in OG5_128614
Echinococcus granulosus dipeptidyl aminopeptidaseprotein Get druggable targets OG5_128614 All targets in OG5_128614
Candida albicans dipeptidyl aminopeptidase B Get druggable targets OG5_128614 All targets in OG5_128614
Loa Loa (eye worm) prolyl oligopeptidase Get druggable targets OG5_128614 All targets in OG5_128614
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein Get druggable targets OG5_128614 All targets in OG5_128614
Schistosoma japonicum ko:K01278 dipeptidyl-peptidase 4, putative Get druggable targets OG5_128614 All targets in OG5_128614
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Dipeptidyl peptidase IV   766 aa 646 aa 26.9 %
Candida albicans dipeptidyl aminopeptidase similar to S. cerevisiae STE13 (YOR219C) involved in maturation of alpha-factor Dipeptidyl peptidase IV   766 aa 807 aa 25.4 %
Candida albicans dipeptidyl aminopeptidase similar to S. cerevisiae STE13 (YOR219C) involved in maturation of alpha-factor Dipeptidyl peptidase IV   766 aa 807 aa 25.4 %
Echinococcus granulosus Dipeptidyl peptidase 9 Dipeptidyl peptidase IV   766 aa 661 aa 26.3 %
Onchocerca volvulus Dipeptidyl peptidase IV   766 aa 799 aa 30.3 %
Echinococcus multilocularis Dipeptidyl peptidase 9 Dipeptidyl peptidase IV   766 aa 614 aa 25.2 %
Leishmania braziliensis dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B Dipeptidyl peptidase IV   766 aa 706 aa 24.6 %
Dictyostelium discoideum hypothetical protein Dipeptidyl peptidase IV   766 aa 672 aa 25.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.007 0.1136 0.6031
Toxoplasma gondii ornithine aminotransferase, mitochondrial precursor, putative 0.0021 0.0171 0.0667
Brugia malayi Calcitonin receptor-like protein seb-1 0.0104 0.1791 0.4306
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0302 0.671
Echinococcus granulosus lysine specific demethylase 5A 0.0041 0.0566 0.0712
Trypanosoma brucei polo-like protein kinase 0.0106 0.1828 1
Echinococcus multilocularis Aminotransferase class III 0.0021 0.0171 0.0215
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0035 0.0448 0.2081
Toxoplasma gondii Erv1 / Alr family protein 0.0035 0.0448 0.2835
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.007 0.1136 0.6031
Echinococcus granulosus jumonji domain containing protein 0.0045 0.0649 0.0816
Echinococcus granulosus prolyl endopeptidase 0.0017 0.0086 0.0108
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0082 0.1364 0.3278
Onchocerca volvulus Serine\/threonine kinase homolog 0.0106 0.1828 0.3726
Loa Loa (eye worm) hypothetical protein 0.0056 0.0855 0.2052
Trichomonas vaginalis set domain proteins, putative 0.0256 0.4761 1
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0399 0.0502
Loa Loa (eye worm) TAR-binding protein 0.0065 0.1029 0.2472
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.007 0.1136 0.6031
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0399 0.2453
Plasmodium vivax ornithine aminotransferase, putative 0.0021 0.0171 0.1221
Schistosoma mansoni serine/threonine protein kinase 0.0106 0.1828 0.2296
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0017 0.0086 0.0103
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0107 0.185 0.2328
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Leishmania major hypothetical protein, conserved 0.0035 0.0448 0.2081
Toxoplasma gondii Erv1 / Alr family protein 0.0035 0.0448 0.2835
Loa Loa (eye worm) hypothetical protein 0.0017 0.0086 0.02
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0082 0.1364 0.1289
Mycobacterium leprae PROBABLE GLUTAMATE-1-SEMIALDEHYDE 2,1-AMINOMUTASE HEML (GSA) (GLUTAMATE-1-SEMIALDEHYDE AMINOTRANSFERASE) (GSA-AT) 0.0021 0.0171 0.0334
Mycobacterium ulcerans esterase/lipase LipP 0.0082 0.1364 0.5002
Brugia malayi beta-lactamase family protein 0.0082 0.1364 0.3278
Mycobacterium ulcerans hypothetical protein 0.0082 0.1364 0.5002
Brugia malayi hypothetical protein 0.0054 0.0812 0.1949
Loa Loa (eye worm) hypothetical protein 0.0017 0.0086 0.02
Loa Loa (eye worm) inositol-1 0.0042 0.0581 0.1394
Onchocerca volvulus 0.0256 0.4761 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0042 0.0581 0.2846
Echinococcus multilocularis lysine specific demethylase 5A 0.0039 0.0533 0.0671
Mycobacterium ulcerans beta-lactamase 0.0082 0.1364 0.5002
Echinococcus granulosus tar DNA binding protein 0.0065 0.1029 0.1295
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0104 0.1797 0.4322
Brugia malayi Pre-SET motif family protein 0.0033 0.0402 0.0963
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0302 0.1244
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0104 0.1797 0.2261
Leishmania major hypothetical protein, conserved 0.0082 0.1364 0.7338
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Brugia malayi serine/threonine-protein kinase plk-2 0.0106 0.1828 0.4395
Echinococcus multilocularis ornithine aminotransferase 0.0021 0.0171 0.0215
Loa Loa (eye worm) hypothetical protein 0.0104 0.1791 0.4306
Trichomonas vaginalis esterase, putative 0.0082 0.1364 0.2734
Echinococcus granulosus cpg binding protein 0.0031 0.0369 0.0464
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0031 0.0367 0.0461
Plasmodium falciparum phd finger protein, putative 0.0033 0.0399 0.8897
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0104 0.1797 0.2257
Brugia malayi 4-aminobutyrate aminotransferase, mitochondrial precursor 0.0021 0.0171 0.0405
Mycobacterium tuberculosis Probable lipase LipE 0.0082 0.1364 0.1289
Schistosoma mansoni hypothetical protein 0.0033 0.0404 0.0503
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0033 0.0404 0.0965
Trypanosoma cruzi hypothetical protein, conserved 0.0082 0.1364 0.7338
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0021 0.0171 0.0334
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0402 0.0502
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0035 0.0448 0.0564
Loa Loa (eye worm) hypothetical protein 0.0028 0.0302 0.0721
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0566 0.0708
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.0302 0.2188
Mycobacterium ulcerans ornithine aminotransferase RocD1 and RocD2 0.0021 0.0171 0.0334
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.0147 0.2641 1
Brugia malayi MH2 domain containing protein 0.0136 0.2425 0.5833
Mycobacterium ulcerans lipase LipD 0.0082 0.1364 0.5002
Onchocerca volvulus Alhambra homolog 0.0033 0.0399 0.0671
Loa Loa (eye worm) jmjC domain-containing protein 0.0067 0.1078 0.259
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0082 0.1364 0.3278
Echinococcus multilocularis GPCR, family 2 0.0033 0.0404 0.0508
Brugia malayi TAR-binding protein 0.0065 0.1029 0.2472
Brugia malayi Inositol-1 0.0042 0.0581 0.1394
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0402 0.0502
Echinococcus multilocularis tar DNA binding protein 0.0065 0.1029 0.1295
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0107 0.185 0.2328
Trichomonas vaginalis inositol monophosphatase, putative 0.0042 0.0581 0.106
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0209 0.3851 0.8053
Echinococcus granulosus beta LACTamase domain containing family member 0.0082 0.1364 0.1716
Onchocerca volvulus 0.0033 0.0402 0.0678
Brugia malayi PHD-finger family protein 0.0033 0.0399 0.0955
Brugia malayi Augmenter of liver regeneration 0.0035 0.0448 0.1072
Mycobacterium ulcerans L-lysine aminotransferase 0.0021 0.0171 0.0334
Schistosoma mansoni cpg binding protein 0.0031 0.0369 0.0459
Trypanosoma cruzi hypothetical protein, conserved 0.0082 0.1364 0.7338
Entamoeba histolytica serine/threonine protein kinase, putative 0.0106 0.1828 1
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.1029 0.2472
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Mycobacterium tuberculosis Probable acetylornithine aminotransferase ArgD 0.0021 0.0171 0.0086
Brugia malayi latrophilin 2 splice variant baaae 0.0071 0.1149 0.276
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0064 0.1004 0.1259
Mycobacterium tuberculosis Conserved protein 0.0082 0.1364 0.1289
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0581 0.2846
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0035 0.0448 0.2081
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0021 0.0171 0.0334
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0004 0.0005
Plasmodium falciparum peptidase, putative 0.0017 0.0086 0.182
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.1029 0.2472
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0035 0.0448 0.0564
Onchocerca volvulus 0.0082 0.1364 0.2734
Brugia malayi Bromodomain containing protein 0.0033 0.0399 0.0955
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0104 0.1797 0.2261
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.0035 0.0448 0.3261
Onchocerca volvulus 0.0082 0.1364 0.2734
Schistosoma mansoni jumonji domain containing protein 0.0085 0.1421 0.1784
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Toxoplasma gondii histone lysine methyltransferase SET1 0.0057 0.0874 0.6164
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0399 0.0955
Toxoplasma gondii ABC1 family protein 0.0082 0.1364 1
Echinococcus granulosus Aminotransferase class III 0.0021 0.0171 0.0215
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.0784 0.1495
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.007 0.1136 0.1425
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1029 0.1291
Brugia malayi hypothetical protein 0.0018 0.0111 0.026
Mycobacterium tuberculosis Conserved protein 0.0082 0.1364 0.1289
Schistosoma mansoni jumonji/arid domain-containing protein 0.0041 0.0566 0.0708
Plasmodium vivax SET domain protein, putative 0.0033 0.0402 0.2925
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0033 0.0404 0.0508
Loa Loa (eye worm) RNA binding protein 0.0065 0.1029 0.2472
Mycobacterium ulcerans acetylornithine aminotransferase 0.0021 0.0171 0.0334
Trypanosoma cruzi ERV/ALR sulfhydryl oxidase domain-containing protein 0.0035 0.0448 0.2081
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0106 0.1828 0.2299
Brugia malayi F/Y-rich N-terminus family protein 0.0021 0.0169 0.04
Brugia malayi CXXC zinc finger family protein 0.0029 0.0336 0.0803
Brugia malayi prolyl oligopeptidase family protein 0.0017 0.0086 0.02
Brugia malayi hypothetical protein 0.0028 0.0302 0.0721
Giardia lamblia Kinase, PLK 0.0106 0.1828 1
Chlamydia trachomatis glutamate-1-semialdehyde-2,1-aminomutase 0.0021 0.0171 0.5
Schistosoma mansoni hypothetical protein 0.0033 0.0404 0.0503
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0017 0.0086 0.0103
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0402 0.0502
Plasmodium falciparum ornithine aminotransferase 0.0021 0.0171 0.3745
Loa Loa (eye worm) hypothetical protein 0.0054 0.0812 0.1949
Trichomonas vaginalis CAMK family protein kinase 0.0052 0.0784 0.1495
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0104 0.1791 0.4306
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0038 0.0495 0.0413
Mycobacterium leprae conserved hypothetical protein 0.0082 0.1364 0.5002
Loa Loa (eye worm) prolyl oligopeptidase 0.0209 0.3851 0.9266
Brugia malayi beta-lactamase 0.0082 0.1364 0.3278
Mycobacterium tuberculosis Probable aminotransferase 0.0147 0.2641 0.2578
Trichomonas vaginalis penicillin-binding protein, putative 0.0082 0.1364 0.2734
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0082 0.1364 0.1289
Echinococcus multilocularis ornithine aminotransferase 0.0021 0.0171 0.0215
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0209 0.3851 0.4845
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0042 0.0581 0.194
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1029 0.1291
Plasmodium vivax hypothetical protein, conserved 0.0082 0.1364 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0581 0.106
Brugia malayi prolyl oligopeptidase family protein 0.0209 0.3851 0.9266
Loa Loa (eye worm) hypothetical protein 0.0017 0.0086 0.02
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0033 0.0402 0.0502
Trichomonas vaginalis D-aminoacylase, putative 0.0082 0.1364 0.2734
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1029 0.1291
Echinococcus multilocularis prolyl endopeptidase 0.0017 0.0086 0.0108
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0399 0.2453
Mycobacterium leprae Probable Acetylornithine aminotransferase ArgD 0.0021 0.0171 0.0334
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0402 0.0506
Schistosoma mansoni hypothetical protein 0.0033 0.0404 0.0503
Brugia malayi Pre-SET motif family protein 0.0225 0.4156 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0033 0.0404 0.0965
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0017 0.0086 0.0103
Schistosoma mansoni inositol monophosphatase 0.0042 0.0581 0.0727
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.0302 0.1244
Brugia malayi RNA binding protein 0.0065 0.1029 0.2472
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0033 0.0404 0.0508
Brugia malayi beta-lactamase family protein 0.0082 0.1364 0.3278
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0038 0.0495 0.1604
Schistosoma mansoni inositol monophosphatase 0.0042 0.0581 0.0727
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0581 0.2846
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0082 0.1364 0.1289
Echinococcus granulosus inositol monophosphatase 1 0.0042 0.0581 0.0731
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Echinococcus multilocularis peregrin 0.0033 0.0399 0.0502
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0136 0.0166
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0104 0.1797 0.4322
Mycobacterium tuberculosis Probable ornithine aminotransferase (N-terminus part) RocD1 (ornithine--oxo-acid aminotransferase) 0.0021 0.0171 0.0086
Echinococcus multilocularis acylamino acid releasing enzyme 0.0017 0.0086 0.0108
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0106 0.1828 0.4395
Echinococcus multilocularis jumonji domain containing protein 0.0045 0.0649 0.0816
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0209 0.3851 0.4845
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0042 0.0581 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0402 0.0506
Mycobacterium tuberculosis Probable esterase LipL 0.0082 0.1364 0.1289
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0209 0.3851 0.4842
Trichomonas vaginalis D-aminoacylase, putative 0.0082 0.1364 0.2734
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0104 0.1791 0.4306
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.007 0.1136 0.6031
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Mycobacterium leprae Probable 4-aminobutyrate aminotransferase GabT (GAMMA-AMINO-N-BUTYRATE TRANSAMINASE) (GABA TRANSAMINASE) (GLUTAMATE:SUCCINIC SEM 0.0021 0.0171 0.0334
Echinococcus multilocularis beta LACTamase domain containing family member 0.0082 0.1364 0.1716
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0225 0.4156 1
Loa Loa (eye worm) hypothetical protein 0.0071 0.1149 0.276
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.0302 0.1695
Loa Loa (eye worm) hypothetical protein 0.0033 0.0402 0.0963
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0104 0.1797 0.2257
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.0147 0.2641 0.5466
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0104 0.1797 0.2261
Loa Loa (eye worm) beta-lactamase 0.0082 0.1364 0.3278
Echinococcus granulosus GPCR family 2 0.0033 0.0404 0.0508
Schistosoma mansoni hypothetical protein 0.0419 0.7948 1
Schistosoma mansoni hypothetical protein 0.0033 0.0399 0.0497
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0042 0.0581 0.3878
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0581 0.2846
Mycobacterium ulcerans hypothetical protein 0.0147 0.2641 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0033 0.0404 0.0508
Brugia malayi Latrophilin receptor protein 2 0.0033 0.0404 0.0965
Onchocerca volvulus 0.0029 0.0336 0.0536
Brugia malayi prolyl oligopeptidase family protein 0.0017 0.0086 0.02
Mycobacterium leprae Probable lipase LipE 0.0082 0.1364 0.5002
Mycobacterium ulcerans glutamate-1-semialdehyde aminotransferase 0.0021 0.0171 0.0334
Loa Loa (eye worm) hypothetical protein 0.0033 0.0399 0.0955
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0106 0.1828 0.2299
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0082 0.1364 0.1712
Loa Loa (eye worm) prolyl oligopeptidase 0.0017 0.0086 0.02
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0402 0.0506
Echinococcus granulosus dnaJ subfamily B 0.0419 0.7948 1
Echinococcus granulosus ornithine aminotransferase 0.0021 0.0171 0.0215
Giardia lamblia PHD finger protein 15 0.0033 0.0399 0.18
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0399 0.0502
Echinococcus multilocularis cpg binding protein 0.0031 0.0369 0.0464
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0399 0.2901
Trypanosoma brucei hypothetical protein, conserved 0.0082 0.1364 0.7338
Echinococcus multilocularis dnaJ subfamily B 0.0419 0.7948 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0106 0.1828 1
Schistosoma mansoni kinase 0.0054 0.0812 0.1017
Trichomonas vaginalis penicillin-binding protein, putative 0.0082 0.1364 0.2734
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0004 0.0005
Brugia malayi prolyl oligopeptidase family protein 0.0017 0.0086 0.02
Loa Loa (eye worm) jmjC domain-containing protein 0.0041 0.0566 0.1357
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0402 0.2479
Loa Loa (eye worm) hypothetical protein 0.0082 0.1364 0.3278
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0399 0.0497
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0082 0.1364 0.5002
Echinococcus multilocularis Dipeptidyl peptidase 9 0.007 0.1136 0.143
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1029 0.1291
Brugia malayi jmjC domain containing protein 0.0041 0.0566 0.1357
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.007 0.1136 0.8219
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Schistosoma mansoni hypothetical protein 0.0071 0.1149 0.1441
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.0302 0.671
Mycobacterium tuberculosis Probable L-lysine-epsilon aminotransferase Lat (L-lysine aminotransferase) (lysine 6-aminotransferase) 0.0021 0.0171 0.0086
Trypanosoma cruzi hypothetical protein, conserved 0.0017 0.0086 0.0000001511
Trypanosoma brucei ERV/ALR sulfhydryl oxidase domain-containing protein 0.0035 0.0448 0.2081
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.0302 0.1244
Echinococcus granulosus acylamino acid releasing enzyme 0.0017 0.0086 0.0108
Echinococcus multilocularis inositol monophosphatase 1 0.0042 0.0581 0.0731
Schistosoma mansoni cpg binding protein 0.0029 0.0336 0.0418
Mycobacterium tuberculosis Probable lipase LipD 0.0082 0.1364 0.1289
Mycobacterium tuberculosis Conserved protein 0.0082 0.1364 0.1289
Onchocerca volvulus 0.0082 0.1364 0.2734
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.007 0.1136 0.6031
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0033 0.0404 0.0508
Trichomonas vaginalis D-aminoacylase, putative 0.0082 0.1364 0.2734
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0017 0.0086 0.0103
Plasmodium vivax hypothetical protein, conserved 0.0017 0.0086 0.0593
Schistosoma mansoni ornithine--oxo-acid transaminase 0.0021 0.0171 0.021
Brugia malayi prolyl oligopeptidase family protein 0.007 0.1136 0.273
Schistosoma mansoni hypothetical protein 0.0033 0.0404 0.0503
Mycobacterium tuberculosis Probable hydrolase 0.0082 0.1364 0.1289
Trichomonas vaginalis CAMK family protein kinase 0.0106 0.1828 0.3726
Mycobacterium tuberculosis Probable glutamate-1-semialdehyde 2,1-aminomutase HemL (GSA) (glutamate-1-semialdehyde aminotransferase) (GSA-at) 0.0021 0.0171 0.0086
Loa Loa (eye worm) hypothetical protein 0.0033 0.0404 0.0965
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0082 0.1364 0.1712
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.0147 0.2641 0.2578
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0106 0.1828 1
Trypanosoma cruzi hypothetical protein, conserved 0.0017 0.0086 0.0000001511
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0104 0.1797 0.2257
Loa Loa (eye worm) MH2 domain-containing protein 0.0136 0.2425 0.5833
Brugia malayi jmjC domain containing protein 0.0107 0.185 0.4449
Schistosoma mansoni cpg binding protein 0.0031 0.0369 0.0459
Loa Loa (eye worm) transcription factor SMAD2 0.0136 0.2425 0.5833
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0104 0.1797 0.2261
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0581 0.2846
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0581 0.106
Echinococcus granulosus Dipeptidyl peptidase 9 0.007 0.1136 0.143
Trypanosoma cruzi polo-like protein kinase, putative 0.0106 0.1828 1
Leishmania major hypothetical protein, conserved 0.0028 0.0302 0.1244
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0336 0.0803
Mycobacterium leprae PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA 0.0147 0.2641 1
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1029 0.1291
Plasmodium falciparum FAD-linked sulfhydryl oxidase ERV1, putative 0.0035 0.0448 1
Loa Loa (eye worm) hepatopoietin HPO2 0.0035 0.0448 0.1072
Echinococcus granulosus peregrin 0.0033 0.0399 0.0502

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 12076 nM Inhibition of pig kidney DPP4 by spectrophotometric method ChEMBL. 19643608

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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