Detailed information for compound 170334

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 508.19 | Formula: C18H18Br2N7O-
  • H donors: 2 H acceptors: 2 LogP: 4.66 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 2
  • SMILES: C[n+]1c(COc2ccc(cc2)/C=N\Nc2nc[nH]n2)cn2c1cccc2.[Br-].[Br-]
  • InChi: 1S/C18H18N7O.2BrH/c1-24-15(11-25-9-3-2-4-17(24)25)12-26-16-7-5-14(6-8-16)10-20-22-18-19-13-21-23-18;;/h2-11,13H,12H2,1H3,(H2,19,21,22,23);2*1H/q+1;;/p-2/b20-10+;;
  • InChiKey: NYEUNSCCLQKXGI-QOFFZXOYSA-L  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0233 0.4075 0.7273
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0028 0.0233 0.0374
Trichomonas vaginalis conserved hypothetical protein 0.0046 0.0567 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0046 0.0567 0.0911
Entamoeba histolytica prolyl oligopeptidase family protein 0.0046 0.0567 1
Trichomonas vaginalis D-aminoacylase, putative 0.0028 0.0233 0.09
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.02 0.3454 0.3454
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0037 0.0397 0.0622
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0233 0.4075 0.7273
Mycobacterium tuberculosis Probable peptidase 0.0046 0.0567 0.1161
Trypanosoma cruzi hypothetical protein, conserved 0.0028 0.0233 0.0062
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0081 0.1213 0.195
Brugia malayi beta-lactamase family protein 0.0028 0.0233 0.0374
Schistosoma mansoni acylaminoacyl-peptidase (S09 family) 0.0046 0.0567 0.0628
Brugia malayi Serine carboxypeptidase S28 family protein 0.0027 0.02 0.0321
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0564 0.0625
Mycobacterium leprae PROBABLE PROTEASE II PTRBB (OLIGOPEPTIDASE B) 0.0046 0.0567 1
Giardia lamblia Alanyl dipeptidyl peptidase 0.0046 0.0567 1
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0033 0.0322 0.0322
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0028 0.0233 0.0374
Onchocerca volvulus 0.0028 0.0233 0.0374
Trypanosoma cruzi cysteine peptidase, putative 0.0048 0.0593 0.0738
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Onchocerca volvulus 0.0069 0.0991 0.1593
Loa Loa (eye worm) hypothetical protein 0.0069 0.0991 0.1593
Loa Loa (eye worm) hypothetical protein 0.0027 0.02 0.0321
Leishmania major prolyl oligopeptidase, putative,serine peptidase clan SC, family S9A, putative 0.0046 0.0567 0.0631
Mycobacterium ulcerans hypothetical protein 0.0123 0.2004 1
Trypanosoma cruzi cysteine peptidase, putative 0.0048 0.0593 0.0738
Brugia malayi cytoplasmic intermediate filament protein 0.0037 0.0391 0.0628
Echinococcus multilocularis tar DNA binding protein 0.0347 0.6208 0.6208
Echinococcus multilocularis thyroid hormone receptor alpha 0.0216 0.3756 0.3756
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0564 0.0564
Trypanosoma cruzi hypothetical protein, conserved 0.0046 0.0567 0.0689
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.011 0.177 0.2947
Echinococcus multilocularis beta LACTamase domain containing family member 0.0028 0.0233 0.0233
Loa Loa (eye worm) hypothetical protein 0.0033 0.0322 0.0518
Schistosoma mansoni hypothetical protein 0.0033 0.031 0.0344
Leishmania major oligopeptidase B-like protein,serine peptidase, clan SC, family S9A-like protein 0.0046 0.0567 0.0631
Schistosoma mansoni thyroid hormone receptor 0.0216 0.3756 0.4162
Brugia malayi RNA binding protein 0.0347 0.6208 0.9982
Echinococcus multilocularis neuropeptide s receptor 0.0467 0.8471 0.8471
Loa Loa (eye worm) RNA binding protein 0.0347 0.6208 0.9982
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0311 0.5528 1
Entamoeba histolytica hypothetical protein 0.0033 0.031 0.3012
Entamoeba histolytica hypothetical protein 0.0033 0.031 0.3012
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0037 0.0391 0.0628
Schistosoma mansoni hypothetical protein 0.0026 0.0178 0.0197
Brugia malayi hypothetical protein 0.015 0.2513 0.4041
Loa Loa (eye worm) beta-lactamase 0.0028 0.0233 0.0374
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0026 0.0178 0.0178
Schistosoma mansoni hypothetical protein 0.0055 0.0734 0.0813
Trypanosoma brucei serine peptidase, clan SC, family S9A-like protein 0.0046 0.0567 0.0631
Loa Loa (eye worm) hypothetical protein 0.0027 0.02 0.0321
Echinococcus granulosus acylamino acid releasing enzyme 0.0046 0.0567 0.0567
Schistosoma mansoni transcription factor LCR-F1 0.0033 0.031 0.0344
Schistosoma mansoni tar DNA-binding protein 0.0347 0.6208 0.688
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0037 0.0397 0.093
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.011 0.177 0.2903
Loa Loa (eye worm) hypothetical protein 0.015 0.2513 0.4041
Echinococcus multilocularis lamin dm0 0.0069 0.0991 0.0991
Entamoeba histolytica hypothetical protein, conserved 0.0046 0.0567 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0026 0.0178 0.0178
Trichomonas vaginalis Clan SC, family S9, acylaminoacyl-peptidase-like serine peptidase 0.0046 0.0567 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Trypanosoma cruzi cysteine peptidase, putative 0.0048 0.0593 0.0738
Plasmodium vivax hypothetical protein, conserved 0.0046 0.0567 1
Leishmania major cathepsin L-like protease 0.0048 0.0593 0.068
Trichomonas vaginalis D-aminoacylase, putative 0.0028 0.0233 0.09
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0046 0.0567 1
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0033 0.0324 0.0318
Brugia malayi prolyl oligopeptidase family protein 0.0046 0.0567 0.0911
Schistosoma mansoni inositol monophosphatase 0.0037 0.0397 0.044
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0033 0.031 0.031
Trypanosoma brucei Alpha/beta hydrolase domain-containing protein 0.0046 0.0567 0.0631
Trypanosoma brucei prolyl oligopeptidase, putative 0.0046 0.0567 0.0631
Echinococcus granulosus neuropeptide receptor A26 0.0467 0.8471 0.8471
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Loa Loa (eye worm) MH2 domain-containing protein 0.021 0.3636 0.5846
Brugia malayi RNA recognition motif domain containing protein 0.0347 0.6208 0.9982
Trichomonas vaginalis esterase, putative 0.0028 0.0233 0.09
Loa Loa (eye worm) hypothetical protein 0.0027 0.02 0.0321
Loa Loa (eye worm) transcription factor SMAD2 0.021 0.3636 0.5846
Trichomonas vaginalis penicillin-binding protein, putative 0.0028 0.0233 0.09
Schistosoma mansoni lamin 0.0069 0.0991 0.1098
Echinococcus granulosus lamin dm0 0.0069 0.0991 0.0991
Leishmania major cathepsin L-like protease 0.0048 0.0593 0.068
Echinococcus granulosus intermediate filament protein 0.0069 0.0991 0.0991
Leishmania major mitochondrial DNA polymerase beta 0.0233 0.4075 0.7256
Trypanosoma cruzi hypothetical protein, conserved 0.0046 0.0567 0.0689
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0033 0.031 0.031
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0347 0.6219 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0564 0.0907
Echinococcus multilocularis acylamino acid releasing enzyme 0.0046 0.0567 0.0567
Schistosoma mansoni tar DNA-binding protein 0.0347 0.6208 0.688
Brugia malayi beta-lactamase 0.0028 0.0233 0.0374
Onchocerca volvulus 0.0028 0.0233 0.0374
Schistosoma mansoni hypothetical protein 0.0026 0.0178 0.0197
Trypanosoma brucei oligopeptidase b 0.0046 0.0567 0.0631
Schistosoma mansoni tar DNA-binding protein 0.0347 0.6208 0.688
Echinococcus granulosus beta LACTamase domain containing family member 0.0028 0.0233 0.0233
Echinococcus granulosus lamin 0.0069 0.0991 0.0991
Brugia malayi prolyl oligopeptidase family protein 0.0347 0.6219 1
Onchocerca volvulus 0.0027 0.02 0.0321
Brugia malayi hypothetical protein 0.0033 0.031 0.0499
Toxoplasma gondii prolyl endopeptidase 0.0046 0.0567 0.1154
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0397 0.5387
Onchocerca volvulus 0.008 0.1206 0.194
Schistosoma mansoni hypothetical protein 0.02 0.3454 0.3828
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Loa Loa (eye worm) hypothetical protein 0.0032 0.0298 0.048
Trichomonas vaginalis penicillin-binding protein, putative 0.0028 0.0233 0.09
Echinococcus multilocularis Lysosomal Pro X carboxypeptidase 0.0497 0.9023 0.9023
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.011 0.177 0.2903
Schistosoma mansoni lysosomal Pro-Xaa carboxypeptidase (S28 family) 0.0027 0.02 0.0221
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0347 0.6219 0.6219
Echinococcus multilocularis tumor protein p63 0.0549 1 1
Entamoeba histolytica dipeptidyl-peptidase, putative 0.0046 0.0567 1
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0033 0.0314 0.0153
Schistosoma mansoni hypothetical protein 0.0026 0.0178 0.0197
Echinococcus multilocularis Lysosomal Pro X carboxypeptidase 0.0027 0.02 0.02
Brugia malayi Serine protease Z688.6 precursor 0.0027 0.02 0.0321
Trypanosoma cruzi oligopeptidase b 0.0046 0.0567 0.0689
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0564 0.0907
Echinococcus granulosus inositol monophosphatase 1 0.0037 0.0397 0.0397
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0564 0.0564
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0028 0.0233 0.0258
Loa Loa (eye worm) hypothetical protein 0.0027 0.02 0.0321
Echinococcus granulosus tar DNA binding protein 0.0347 0.6208 0.6208
Entamoeba histolytica hypothetical protein 0.0033 0.031 0.3012
Toxoplasma gondii hypothetical protein 0.0046 0.0567 0.1154
Brugia malayi prolyl oligopeptidase family protein 0.0311 0.5528 0.8889
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0564 0.0564
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.0046 0.0567 1
Schistosoma mansoni lamin 0.0069 0.0991 0.1098
Loa Loa (eye worm) hypothetical protein 0.008 0.1206 0.194
Trypanosoma cruzi oligopeptidase b 0.0046 0.0567 0.0689
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0037 0.0397 0.5
Brugia malayi Latrophilin receptor protein 2 0.0026 0.0178 0.0286
Loa Loa (eye worm) hypothetical protein 0.0046 0.0567 0.0911
Echinococcus multilocularis inositol monophosphatase 1 0.0037 0.0397 0.0397
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0311 0.5528 0.5528
Giardia lamblia Alanyl dipeptidyl peptidase 0.0046 0.0567 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0026 0.0178 0.0286
Brugia malayi TAR-binding protein 0.0347 0.6208 0.9982
Schistosoma mansoni inositol monophosphatase 0.0037 0.0397 0.044
Trichomonas vaginalis inositol monophosphatase, putative 0.0037 0.0397 0.5387
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Schistosoma mansoni family S28 unassigned peptidase (S28 family) 0.0497 0.9023 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0397 0.0371
Echinococcus granulosus prolyl endopeptidase 0.0046 0.0567 0.0567
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0397 0.0371
Brugia malayi intermediate filament protein 0.0069 0.0991 0.1593
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0397 0.0311
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Trypanosoma cruzi major cysteine proteinase, putative 0.0037 0.0401 0.0379
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0044 0.0515 0.0592
Brugia malayi Inositol-1 0.0037 0.0397 0.0639
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0033 0.0314 0.0214
Mycobacterium tuberculosis Probable protease II PtrBb [second part] (oligopeptidase B) 0.0046 0.0567 0.1161
Onchocerca volvulus Prolyl endopeptidase homolog 0.0046 0.0567 0.0911
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0311 0.5528 0.6126
Onchocerca volvulus 0.0069 0.0991 0.1593
Echinococcus multilocularis lamin 0.0069 0.0991 0.0991
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0081 0.1213 0.195
Echinococcus multilocularis prolyl endopeptidase 0.0046 0.0567 0.0567
Echinococcus multilocularis musashi 0.0069 0.0991 0.0991
Brugia malayi Serine protease Z688.6 precursor 0.0027 0.02 0.0321
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0028 0.0233 0.0258
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0564 0.0564
Entamoeba histolytica prolyl oligopeptidase family protein 0.0046 0.0567 1
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0311 0.5528 1
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0311 0.5528 1
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0046 0.0567 0.0628
Trypanosoma cruzi serine peptidase, clan SC, family S9A-like protein, putative 0.0046 0.0567 0.0689
Leishmania major cathepsin L-like protease 0.0048 0.0593 0.068
Mycobacterium ulcerans protease II (oligopeptidase B), PtrB 0.0046 0.0567 0.1887
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0033 0.0324 0.2739
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0182 0.3111 1
Trypanosoma cruzi oligopeptidase B-like protein, putative 0.0046 0.0567 0.0689
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0033 0.0314 0.0214
Echinococcus granulosus neuropeptide s receptor 0.0467 0.8471 0.8471
Brugia malayi Intermediate filament tail domain containing protein 0.0069 0.0991 0.1593
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Entamoeba histolytica hypothetical protein 0.0033 0.031 0.3012
Loa Loa (eye worm) TAR-binding protein 0.0347 0.6208 0.9982
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0347 0.6208 0.9982
Echinococcus granulosus Dipeptidyl peptidase 9 0.0311 0.5528 0.5528
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0069 0.0991 0.1593
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0033 0.0314 0.0214
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0046 0.0567 0.0628
Onchocerca volvulus 0.0028 0.0233 0.0374
Schistosoma mansoni tar DNA-binding protein 0.0347 0.6208 0.688
Plasmodium falciparum peptidase, putative 0.0046 0.0567 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0026 0.0178 0.0178
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0033 0.0322 0.0322
Trypanosoma cruzi cruzipain precursor, putative 0.0048 0.0593 0.0738
Brugia malayi latrophilin 2 splice variant baaae 0.0055 0.0734 0.118
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0564 0.0625
Toxoplasma gondii ABC1 family protein 0.0028 0.0233 0.0104
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0311 0.5528 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0233 0.4075 0.7256
Toxoplasma gondii acylaminoacyl-peptidase, putative 0.0046 0.0567 0.1154
Loa Loa (eye worm) hypothetical protein 0.0026 0.0178 0.0286
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0037 0.0397 0.0311
Loa Loa (eye worm) hypothetical protein 0.0081 0.1213 0.195
Echinococcus granulosus GPCR family 2 0.0026 0.0178 0.0178
Trypanosoma brucei prolyl endopeptidase 0.0046 0.0567 0.0631
Loa Loa (eye worm) intermediate filament protein 0.0069 0.0991 0.1593
Brugia malayi prolyl oligopeptidase family protein 0.0046 0.0567 0.0911
Loa Loa (eye worm) inositol-1 0.0037 0.0397 0.0639
Echinococcus multilocularis GPCR, family 2 0.0026 0.0178 0.0178
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0196 0.3382 1
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0311 0.5528 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0567 0.0911
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Echinococcus granulosus Lysosomal Pro X carboxypeptidase 0.0497 0.9023 0.9023
Trichomonas vaginalis D-aminoacylase, putative 0.0028 0.0233 0.09
Schistosoma mansoni cellular tumor antigen P53 0.008 0.1206 0.1337
Schistosoma mansoni thyroid hormone receptor 0.0216 0.3756 0.4162
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Loa Loa (eye worm) hypothetical protein 0.0055 0.0734 0.118
Schistosoma mansoni hypothetical protein 0.0026 0.0178 0.0197
Loa Loa (eye worm) prolyl oligopeptidase 0.0347 0.6219 1
Schistosoma mansoni intermediate filament proteins 0.0069 0.0991 0.1098
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0037 0.0397 0.5387
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Brugia malayi Calcitonin receptor-like protein seb-1 0.0081 0.1213 0.195
Schistosoma mansoni prolyl oligopeptidase (S09 family) 0.0046 0.0567 0.0628
Loa Loa (eye worm) latrophilin receptor protein 2 0.0026 0.0178 0.0286
Loa Loa (eye worm) hypothetical protein 0.0068 0.0967 0.1555
Brugia malayi beta-lactamase family protein 0.0028 0.0233 0.0374
Brugia malayi MH2 domain containing protein 0.021 0.3636 0.5846
Entamoeba histolytica prolyl oligopeptidase family protein 0.0046 0.0567 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0026 0.0178 0.0178
Loa Loa (eye worm) hypothetical protein 0.0028 0.0233 0.0374
Loa Loa (eye worm) hypothetical protein 0.0161 0.2713 0.4362
Schistosoma mansoni tar DNA-binding protein 0.0347 0.6208 0.688
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.004 0.0448 0.0467
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Trypanosoma cruzi hypothetical protein, conserved 0.0028 0.0233 0.0062
Toxoplasma gondii hypothetical protein 0.0038 0.0404 0.0644
Trypanosoma cruzi prolyl endopeptidase 0.0046 0.0567 0.0689
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0347 0.6219 0.6219
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0037 0.0397 0.5387
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0048 0.0593 0.068
Echinococcus granulosus Lysosomal Pro X carboxypeptidase 0.0027 0.02 0.02
Brugia malayi prolyl oligopeptidase family protein 0.0046 0.0567 0.0911
Leishmania major oligopeptidase b 0.0046 0.0567 0.0631
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0564 0.0625
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.02 0.3454 0.3454
Loa Loa (eye worm) hypothetical protein 0.0032 0.0298 0.048
Echinococcus multilocularis neuropeptide receptor A26 0.0467 0.8471 0.8471
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0347 0.6219 0.6892
Mycobacterium tuberculosis Conserved hypothetical protein 0.0123 0.2004 0.6153

Activities

Activity type Activity value Assay description Source Reference
CD50 (functional) ND 0 mg kg-1 Trypanocidal Activity at I.C.E. value 0.23 when administered subcutaneously; ND= Nodata ChEMBL. 2296025
ID50 (functional) = 0.5 ug ml-1 In Vitro measurement of inhibition of thymidine uptake in cell culture of T. rhodesiense ChEMBL. 2296025
ID50 (functional) > 10 ug ml-1 In Vitro measurement of inhibition of leucine uptake in cell culture of T. rhodesiense ChEMBL. 2296025

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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