Detailed information for compound 1132877

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 445.576 | Formula: C26H27N3O2S
  • H donors: 1 H acceptors: 2 LogP: 5.41 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1NC(=O)C(S1)c1ccccc1c1ccc(cc1)CCC1N=CC(=N1)CC1CCCC1
  • InChi: 1S/C26H27N3O2S/c30-25-24(32-26(31)29-25)22-8-4-3-7-21(22)19-12-9-17(10-13-19)11-14-23-27-16-20(28-23)15-18-5-1-2-6-18/h3-4,7-10,12-13,16,18,23-24H,1-2,5-6,11,14-15H2,(H,29,30,31)
  • InChiKey: ZIJRQHVPSNVIQR-UHFFFAOYSA-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 bombesin-like receptor 3 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus pyroglutamylated rfamide peptide receptor bombesin-like receptor 3 399 aa 375 aa 21.1 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0092 0.1028 0.1089
Brugia malayi jmjC domain containing protein 0.0015 0.0057 0.0059
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0036 0.0314 0.0312
Loa Loa (eye worm) histone methyltransferase 0.0018 0.0087 0.009
Schistosoma mansoni Smad4 0.0011 0.0001 0.0003
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.005 0.0499 0.0934
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Echinococcus multilocularis dna polymerase kappa 0.002 0.0115 0.0114
Loa Loa (eye worm) D-ets-2 protein 0.0021 0.0127 0.0133
Echinococcus multilocularis fetal alzheimer antigen, falz 0.005 0.0499 0.0497
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.011 0.1248 0.1322
Echinococcus multilocularis ETS transcription factor Elf 1 0.0021 0.0127 0.0126
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0115 0.0353
Entamoeba histolytica tumor susceptibility gene 101 protein, putative 0.014 0.1634 0.7372
Loa Loa (eye worm) hypothetical protein 0.0749 0.9316 0.9879
Echinococcus multilocularis Kelch repeat type 1 0.0187 0.2223 0.2222
Echinococcus granulosus mothers against decapentaplegic 5 0.0024 0.017 0.0178
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0024 0.017 0.0318
Loa Loa (eye worm) hypothetical protein 0.002 0.0115 0.012
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0075 0.081 0.0808
Schistosoma mansoni hypothetical protein 0.0021 0.0127 0.0238
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0244 0.2942 0.2941
Mycobacterium ulcerans aldehyde dehydrogenase 0.0066 0.0692 0.09
Trypanosoma cruzi hypothetical protein, conserved 0.0034 0.03 0.1126
Loa Loa (eye worm) hypothetical protein 0.0758 0.943 1
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0016 0.0061 0.0153
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Brugia malayi PHD-finger family protein 0.0055 0.0561 0.0593
Loa Loa (eye worm) CXXC zinc finger family protein 0.0057 0.058 0.0614
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.1028 0.1027
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Loa Loa (eye worm) hypothetical protein 0.0092 0.1027 0.1087
Echinococcus granulosus zinc phosphodiesterase 0.0016 0.0061 0.0063
Echinococcus granulosus geminin 0.017 0.201 0.2131
Loa Loa (eye worm) nuclear factor I 0.0013 0.0034 0.0034
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Entamoeba histolytica serine/threonine protein kinase, putative 0.0186 0.2216 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0063 0.0065
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0314 0.0587
Loa Loa (eye worm) DNA-binding protein D-ETS-3 0.0021 0.0127 0.0133
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.011 0.1248 0.5631
Loa Loa (eye worm) MH2 domain-containing protein 0.0024 0.017 0.0178
Schistosoma mansoni Smad4 0.0011 0.0001 0.0003
Schistosoma mansoni smad1 5 8 and 0.0024 0.017 0.0318
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.1028 0.1927
Mycobacterium ulcerans class a beta-lactamase, BlaC 0.0391 0.4792 0.6744
Echinococcus multilocularis ubiquitin specific protease 41 0.011 0.1248 0.1247
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0075 0.081 0.0857
Echinococcus multilocularis metallo beta lactamase domain containing protein 0.0016 0.0061 0.006
Entamoeba histolytica hypothetical protein 0.0034 0.03 0.1355
Echinococcus multilocularis Smad4 0.0024 0.017 0.0168
Entamoeba histolytica hypothetical protein 0.0034 0.03 0.1355
Trypanosoma cruzi hydroxyacylglutathione hydrolase, putative 0.0016 0.0061 0.0017
Brugia malayi hypothetical protein 0.0071 0.0761 0.0806
Echinococcus granulosus zinc finger protein 0.0044 0.0421 0.0445
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0115 0.012
Loa Loa (eye worm) hydroxyacylglutathione hydrolase cytoplasmic 0.0016 0.0061 0.0063
Schistosoma mansoni survival motor neuron protein 0.0047 0.0455 0.0853
Onchocerca volvulus Huntingtin homolog 0.0119 0.1364 0.1463
Schistosoma mansoni phosphatidylserine receptor 0.0015 0.0057 0.0107
Echinococcus multilocularis cpg binding protein 0.0064 0.0671 0.067
Schistosoma mansoni ets-related 0.0434 0.5338 1
Onchocerca volvulus 0.0749 0.9316 1
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0143 0.1668 0.1767
Schistosoma mansoni mixed-lineage leukemia protein mll 0.012 0.1382 0.2589
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0168 0.1979 0.2098
Echinococcus multilocularis ETHE1 protein 0.0016 0.0061 0.006
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0691 0.0731
Trichomonas vaginalis A-type flavoprotein 0.0016 0.0061 0.0153
Onchocerca volvulus 0.0057 0.058 0.0621
Schistosoma mansoni cpg binding protein 0.0064 0.0671 0.1258
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.1028 0.1027
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0057 0.0585 0.0619
Schistosoma mansoni elf1 0.0021 0.0127 0.0238
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0115 0.0267
Echinococcus granulosus ETS transcription factor Elf 2 0.0021 0.0127 0.0133
Schistosoma mansoni methyl-cpg binding protein mbd 0.0036 0.0314 0.0587
Loa Loa (eye worm) hypothetical protein 0.0201 0.2405 0.2549
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Loa Loa (eye worm) hypothetical protein 0.008 0.0874 0.0925
Trypanosoma cruzi metallo-beta-lactamase superfamily, putative 0.0016 0.0061 0.0017
Trypanosoma brucei cleavage and polyadenylation specificity factor subunit, putative 0.0016 0.0061 0.0107
Echinococcus multilocularis GPCR, family 2 0.0016 0.0063 0.0061
Trichomonas vaginalis conserved hypothetical protein 0.011 0.1248 0.5576
Schistosoma mansoni hypothetical protein 0.041 0.5043 0.9448
Echinococcus granulosus tumor susceptibility gene 101 protein 0.0206 0.2465 0.2613
Echinococcus granulosus phd:f box containing protein 0.0015 0.0057 0.0059
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Entamoeba histolytica type A flavoprotein, putative 0.0016 0.0061 0.0275
Trypanosoma cruzi ISWI complex protein 0.0032 0.0267 0.0973
Loa Loa (eye worm) RNA binding protein 0.0065 0.0691 0.0731
Schistosoma mansoni cpg binding protein 0.0064 0.0671 0.1258
Brugia malayi jmjC domain containing protein 0.0015 0.0057 0.0059
Loa Loa (eye worm) hypothetical protein 0.0016 0.0063 0.0065
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0676 0.0715
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.011 0.1248 0.1247
Loa Loa (eye worm) hypothetical protein 0.0013 0.0034 0.0034
Schistosoma mansoni smad 0.0011 0.0001 0.0003
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0291 0.0308
Echinococcus multilocularis phd:f box containing protein 0.0015 0.0057 0.0056
Schistosoma mansoni zinc phosphodiesterase 0.0016 0.0061 0.0114
Trypanosoma cruzi polo-like protein kinase, putative 0.0186 0.2216 1
Trypanosoma brucei beta lactamase 0.0187 0.223 1
Loa Loa (eye worm) hypothetical protein 0.0015 0.0057 0.0059
Entamoeba histolytica hypothetical protein 0.0071 0.0761 0.3433
Schistosoma mansoni hypothetical protein 0.0032 0.0267 0.0501
Schistosoma mansoni tsg101-related 0.0172 0.2031 0.3804
Brugia malayi hypothetical protein 0.0119 0.1364 0.1445
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0115 0.0353
Mycobacterium ulcerans aldehyde dehydrogenase 0.0066 0.0692 0.09
Entamoeba histolytica hypothetical protein 0.0034 0.03 0.1355
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0037 0.0329 0.0617
Trypanosoma brucei ISWI complex protein 0.0032 0.0267 0.1049
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Schistosoma mansoni hypothetical protein 0.0016 0.0063 0.0117
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0024 0.017 0.0168
Echinococcus multilocularis lysine specific demethylase 5A 0.0057 0.0585 0.0584
Loa Loa (eye worm) hypothetical protein 0.0037 0.0329 0.0348
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0014 0.0043 0.0044
Echinococcus granulosus dnaJ subfamily B 0.041 0.5043 0.5347
Brugia malayi metallo-beta-lactamase superfamily protein 0.0016 0.0061 0.0063
Onchocerca volvulus Serine\/threonine kinase homolog 0.0186 0.2216 0.2378
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0691 0.0689
Schistosoma mansoni cpg binding protein 0.0057 0.058 0.1087
Schistosoma mansoni bromodomain containing protein 0.0012 0.0019 0.0035
Schistosoma mansoni serine/threonine protein kinase 0.0186 0.2216 0.4153
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0186 0.2216 0.2349
Echinococcus granulosus Smad4 0.0024 0.017 0.0178
Trypanosoma cruzi metallo-beta-lactamase superfamily, putative 0.0016 0.0061 0.0017
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.011 0.1248 0.1322
Brugia malayi Fli-1 protein 0.0434 0.5338 0.566
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.011 0.1248 0.5515
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.011 0.1248 0.5515
Mycobacterium leprae PROBABLE CONSERVED LIPOPROTEIN LPQF 0.0187 0.223 0.3092
Schistosoma mansoni Smad4 0.0024 0.017 0.0318
Schistosoma mansoni hypothetical protein 0.0071 0.0761 0.1426
Echinococcus multilocularis neuropeptide s receptor 0.0479 0.5908 0.5907
Loa Loa (eye worm) hypothetical protein 0.0015 0.0057 0.0059
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0115 0.0267
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.011 0.1248 0.2338
Loa Loa (eye worm) hypothetical protein 0.0016 0.0061 0.0063
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.1028 0.1927
Loa Loa (eye worm) hypothetical protein 0.0085 0.0936 0.0991
Onchocerca volvulus 0.0016 0.0061 0.0064
Leishmania major DNA polymerase eta, putative 0.002 0.0115 0.0267
Giardia lamblia Kinase, PLK 0.0186 0.2216 1
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0691 0.1294
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0115 0.0267
Brugia malayi Ets-domain containing protein 0.0021 0.0127 0.0133
Echinococcus multilocularis kelch ECH associated protein 1 0.0186 0.2216 0.2215
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0021 0.0127 0.0133
Echinococcus granulosus ETS transcription factor Elf 5 0.0021 0.0127 0.0133
Brugia malayi MH1 domain containing protein 0.0024 0.017 0.0178
Echinococcus multilocularis muscleblind protein 1 0.0758 0.943 0.943
Trypanosoma cruzi polo-like protein kinase, putative 0.0186 0.2216 1
Trypanosoma cruzi glyoxalase II 0.0016 0.0061 0.0017
Loa Loa (eye worm) hypothetical protein 0.0012 0.0019 0.0018
Entamoeba histolytica type A flavoprotein, putative 0.0016 0.0061 0.0275
Onchocerca volvulus 0.0047 0.0455 0.0487
Brugia malayi jmjC domain containing protein 0.0057 0.0585 0.0619
Schistosoma mansoni hypothetical protein 0.017 0.201 0.3766
Entamoeba histolytica alkyl sulfatase, putative 0.0016 0.0061 0.0275
Entamoeba histolytica metallo-beta-lactamase family protein 0.0016 0.0061 0.0275
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.03 0.1247
Loa Loa (eye worm) hypothetical protein 0.0122 0.1406 0.149
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0115 0.0267
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0018 0.0087 0.0085
Brugia malayi hypothetical protein 0.0749 0.9316 0.9879
Echinococcus granulosus neuropeptide receptor A26 0.0479 0.5908 0.6264
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0691 0.1294
Echinococcus granulosus ETS transcription factor Elf 1 0.0021 0.0127 0.0133
Echinococcus granulosus lysine specific demethylase 5A 0.0064 0.0676 0.0715
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Brugia malayi Chain A, Human Glyoxalase Ii With Cacodylate And Acetate Ions Present In The Active Site. 0.0016 0.0061 0.0063
Brugia malayi transcription factor E74 isoform 0.0021 0.0127 0.0133
Entamoeba histolytica alkyl sulfatase, putative 0.0016 0.0061 0.0275
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1029 0.4577
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0128 0.1475 0.1474
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.011 0.1248 0.5515
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0066 0.0692 0.2941
Schistosoma mansoni bromodomain containing protein 0.0135 0.1569 0.2939
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.0115 0.0267
Mycobacterium tuberculosis Probable conserved lipoprotein LpqF 0.0187 0.223 0.3092
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0115 0.04
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Echinococcus multilocularis survival motor neuron protein 1 0.0229 0.2758 0.2757
Mycobacterium ulcerans UDP-galactopyranose mutase Glf 0.0572 0.7076 1
Treponema pallidum ribonuclease Z 0.0016 0.0061 0.5
Schistosoma mansoni hypothetical protein 0.0034 0.0291 0.0546
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Schistosoma mansoni zinc finger protein 0.0044 0.0421 0.0788
Loa Loa (eye worm) hypothetical protein 0.0119 0.1364 0.1445
Leishmania major cleavage and polyadenylation specificity factor, putative 0.0016 0.0061 0.0017
Trypanosoma cruzi glyoxalase II 0.0016 0.0061 0.0017
Echinococcus granulosus lysine specific demethylase 6a 0.0015 0.0057 0.0059
Echinococcus multilocularis zinc phosphodiesterase 0.0016 0.0061 0.006
Entamoeba histolytica metallo-beta-lactamase superfamily protein 0.0016 0.0061 0.0275
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Plasmodium vivax unspecified product 0.0016 0.0061 1
Brugia malayi jmjC domain containing protein 0.0015 0.0057 0.0059
Brugia malayi jmjC domain containing protein 0.0015 0.0057 0.0059
Echinococcus granulosus JmjC domain containing protein 4 0.0015 0.0057 0.0059
Echinococcus granulosus kelch ECH associated protein 1 like 0.0186 0.2216 0.2349
Schistosoma mansoni protein phosphatase 2C 0.0015 0.0057 0.0107
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0014 0.0043 0.0042
Loa Loa (eye worm) hypothetical protein 0.0119 0.1364 0.1445
Entamoeba histolytica metallo-beta-lactamase superfamily protein 0.0016 0.0061 0.0275
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0128 0.1475 0.1563
Echinococcus granulosus ETS transcription factor Elf 2 0.0021 0.0127 0.0133
Echinococcus granulosus hydroxyacylglutathione hydrolase 0.0016 0.0061 0.0063
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Echinococcus multilocularis zinc finger protein 0.0044 0.0421 0.0419
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0115 0.0077
Toxoplasma gondii hydroxyacylglutathione hydrolase 0.0016 0.0061 0.003
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Echinococcus multilocularis hydroxyacylglutathione hydrolase 0.0016 0.0061 0.006
Trypanosoma brucei unspecified product 0.002 0.0115 0.0353
Trypanosoma cruzi hypothetical protein, conserved 0.0034 0.03 0.1126
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Brugia malayi hypothetical protein 0.0206 0.2465 0.2613
Leishmania major hydroxyacylglutathione hydrolase, putative,glyoxalase II, putative 0.0016 0.0061 0.0017
Echinococcus multilocularis ETS transcription factor Elf 2 0.0021 0.0127 0.0126
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0022 0.0148 0.0156
Trypanosoma brucei glyoxalase II 0.0016 0.0061 0.0107
Echinococcus multilocularis ETS domain containing protein Elk 1 0.0021 0.0127 0.0126
Loa Loa (eye worm) ets-domain-containing protein 0.0021 0.0127 0.0133
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0186 0.2216 0.2215
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0115 0.0353
Echinococcus granulosus survival motor neuron protein 1 0.0229 0.2758 0.2924
Echinococcus granulosus muscleblind protein 0.0758 0.943 1
Loa Loa (eye worm) PHD-finger family protein 0.0043 0.0408 0.0431
Plasmodium vivax hydroxyacyl glutathione hydrolase, putative 0.0016 0.0061 1
Echinococcus multilocularis ewsr:fli fusion protein type 0.0021 0.0127 0.0126
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Brugia malayi metallo-beta-lactamase superfamily protein 0.0016 0.0061 0.0063
Echinococcus multilocularis smad 0.0024 0.017 0.0168
Trypanosoma cruzi glyoxalase II 0.0016 0.0061 0.0017
Echinococcus granulosus ubiquitin specific protease 41 0.011 0.1248 0.1322
Echinococcus granulosus ETS domain containing protein Elk 1 0.0021 0.0127 0.0133
Loa Loa (eye worm) fli-1 protein 0.0434 0.5338 0.566
Echinococcus multilocularis dnaJ subfamily B 0.041 0.5043 0.5042
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.011 0.1248 0.5576
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.011 0.1248 0.5576
Echinococcus multilocularis ETS transcription factor Elf 2 0.0021 0.0127 0.0126
Schistosoma mansoni hypothetical protein 0.0043 0.0408 0.0764
Echinococcus multilocularis JmjC domain containing protein 4 0.0015 0.0057 0.0056
Trypanosoma brucei polo-like protein kinase 0.0186 0.2216 0.9938
Schistosoma mansoni jumonji/arid domain-containing protein 0.0064 0.0676 0.1266
Entamoeba histolytica hypothetical protein 0.0071 0.0761 0.3433
Brugia malayi MH2 domain containing protein 0.0354 0.4329 0.459
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0015 0.0057 0.0107
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0037 0.0329 0.0617
Brugia malayi MH2 domain containing protein 0.0024 0.017 0.0178
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0063 0.0061
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0066 0.0692 0.0733
Echinococcus granulosus cpg binding protein 0.0064 0.0671 0.071
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0115 0.0077
Leishmania major DNA polymerase kappa, putative 0.002 0.0115 0.0267
Wolbachia endosymbiont of Brugia malayi metallo-beta-lactamase superfamily hydrolase 0.0016 0.0061 0.5
Echinococcus multilocularis dna polymerase eta 0.002 0.0115 0.0114
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0201 0.2405 0.2549
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.0115 0.0077
Schistosoma mansoni hypothetical protein 0.0016 0.0063 0.0117
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Chlamydia trachomatis ribonuclease Z 0.0016 0.0061 0.5
Mycobacterium leprae Probable UDP-galactopyranose mutase Glf (UDP-galp mutase) (NAD+-flavin adenine dinucleotide-requiring enzyme) 0.0572 0.7076 1
Brugia malayi Bromodomain containing protein 0.008 0.0872 0.0923
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0018 0.0087 0.009
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Echinococcus granulosus metallo beta lactamase domain containing protein 0.0016 0.0061 0.0063
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.1028 0.1089
Brugia malayi Muscleblind-like protein 0.0758 0.943 1
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Toxoplasma gondii metallo-beta-lactamase domain-containing protein 0.0016 0.0061 0.003
Schistosoma mansoni ets-related 0.0021 0.0127 0.0238
Leishmania major metallo-beta-lactamase family protein-like protein 0.0016 0.0061 0.0017
Brugia malayi MH1 domain containing protein 0.0013 0.0034 0.0034
Loa Loa (eye worm) hypothetical protein 0.0758 0.943 1
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Loa Loa (eye worm) hydroxyacylglutathione hydrolase 0.0016 0.0061 0.0063
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0015 0.0057 0.009
Schistosoma mansoni hypothetical protein 0.0016 0.0061 0.0114
Loa Loa (eye worm) hypothetical protein 0.0229 0.2758 0.2924
Entamoeba histolytica hypothetical protein, conserved 0.0016 0.0061 0.0275
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.011 0.1248 0.2338
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0115 0.0518
Onchocerca volvulus Putative hydrolase PNKD 0.0016 0.0061 0.0064
Echinococcus granulosus kelch ECH associated protein 1 0.0186 0.2216 0.2349
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0057 0.0059
Echinococcus multilocularis protein C ets 2 0.0021 0.0127 0.0126
Trypanosoma brucei Vps23 core domain containing protein, putative 0.0066 0.0697 0.3008
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0244 0.2942 0.5512
Schistosoma mansoni transcription factor LCR-F1 0.0071 0.0761 0.1426
Schistosoma mansoni jumonji domain containing protein 0.0015 0.0057 0.0107
Echinococcus granulosus dna polymerase kappa 0.002 0.0115 0.012
Brugia malayi MH2 domain containing protein 0.0024 0.017 0.0178
Mycobacterium ulcerans lipoprotein LpqF 0.0187 0.223 0.3092
Trypanosoma cruzi metallo-beta-lactamase-like protein, putative 0.0016 0.0061 0.0017
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Schistosoma mansoni smad1 5 8 and 0.0024 0.017 0.0318
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0066 0.0692 0.09
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Plasmodium falciparum JmjC domain-containing protein, putative 0.0015 0.0057 0.9393
Loa Loa (eye worm) metallo-beta-lactamase superfamily protein 0.0016 0.0061 0.0063
Echinococcus multilocularis lysine specific demethylase 6a 0.0015 0.0057 0.0056
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0022 0.0148 0.0147
Schistosoma mansoni hypothetical protein 0.0047 0.0455 0.0853
Echinococcus granulosus methyl CpG binding domain protein 2 0.0036 0.0314 0.0331
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0186 0.2216 1
Brugia malayi hypothetical protein 0.0016 0.0061 0.0063
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Schistosoma mansoni smad 0.0024 0.017 0.0318
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Entamoeba histolytica hypothetical protein 0.0071 0.0761 0.3433
Schistosoma mansoni tsg101-related 0.014 0.1634 0.3061
Mycobacterium ulcerans aldehyde dehydrogenase 0.0066 0.0692 0.09
Entamoeba histolytica metallo-beta-lactamase family protein 0.0016 0.0061 0.0275
Echinococcus multilocularis jumonji domain containing 1A 0.0015 0.0057 0.0056
Schistosoma mansoni hydroxyacylglutathione hydrolase (Glyoxalase II) (Glx II) 0.0016 0.0061 0.0114
Echinococcus granulosus histone lysine methyltransferase setb 0.0037 0.0329 0.0348
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0691 0.1294
Echinococcus multilocularis metallo beta lactamase domain containing protein 0.0016 0.0061 0.006
Brugia malayi Bromodomain containing protein 0.0159 0.1877 0.1989
Loa Loa (eye worm) Smad1 0.0024 0.017 0.0178
Loa Loa (eye worm) bromodomain containing protein 0.0037 0.033 0.0348
Schistosoma mansoni aldehyde dehydrogenase 0.0066 0.0692 0.1297
Echinococcus granulosus neuropeptide s receptor 0.0479 0.5908 0.6264
Echinococcus multilocularis ETS transcription factor Elf 5 0.0021 0.0127 0.0126
Schistosoma mansoni zinc finger protein 0.0032 0.0267 0.0501
Loa Loa (eye worm) MH2 domain-containing protein 0.0354 0.4329 0.459
Schistosoma mansoni tsg101-related 0.0172 0.2031 0.3804
Echinococcus multilocularis ets variant gene 4 0.0021 0.0127 0.0126
Loa Loa (eye worm) transcription factor SMAD2 0.0354 0.4329 0.459
Echinococcus granulosus ewsr:fli fusion protein type 0.0021 0.0127 0.0133
Schistosoma mansoni phd/f-box containing protein 0.0015 0.0057 0.0107
Echinococcus granulosus kelch ECH associated protein 1 like 0.0186 0.2216 0.2349
Schistosoma mansoni hypothetical protein 0.0016 0.0061 0.0114
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0063 0.0065
Trypanosoma cruzi Vps23 core domain containing protein, putative 0.0066 0.0697 0.2962
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0071 0.0761 0.0806
Brugia malayi DNA-binding protein D-ETS-3 0.0021 0.0127 0.0133
Brugia malayi CXXC zinc finger family protein 0.0057 0.058 0.0614
Schistosoma mansoni jumonji domain containing protein 0.0057 0.0585 0.1096
Schistosoma mansoni aldehyde dehydrogenase 0.0066 0.0692 0.1297
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0063 0.0065
Trypanosoma brucei UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1199
Entamoeba histolytica hypothetical protein 0.0034 0.03 0.1355
Brugia malayi F/Y-rich N-terminus family protein 0.0021 0.0134 0.0141
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.1028 0.1089
Entamoeba histolytica metallo-beta-lactamase family protein 0.0016 0.0061 0.0275
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0115 0.04
Loa Loa (eye worm) MH1 domain-containing protein 0.0024 0.017 0.0178
Schistosoma mansoni DNA polymerase eta 0.002 0.0115 0.0215
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.011 0.1248 0.1247
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0057 0.0585 0.0584
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0057 0.0059
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.011 0.1248 0.5521
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0115 0.0267
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0455 0.0482
Brugia malayi Smad1 0.0024 0.017 0.0178
Leishmania major hypothetical protein, conserved 0.0032 0.0267 0.0973
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0691 0.0731
Schistosoma mansoni hypothetical protein 0.0016 0.0063 0.0117
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0014 0.0043 0.0042
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0115 0.0353
Schistosoma mansoni hypothetical protein 0.0016 0.0061 0.0114
Schistosoma mansoni smad1 5 8 and 0.0024 0.017 0.0318
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0691 0.1294
Echinococcus granulosus GA binding protein alpha chain 0.0143 0.1668 0.1767
Schistosoma mansoni zinc phosphodiesterase 0.0016 0.0061 0.0114
Echinococcus multilocularis geminin 0.017 0.201 0.2009
Trypanosoma brucei metallo-beta-lactamase-like protein, putative 0.0016 0.0061 0.0107
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0168 0.1979 0.1978
Giardia lamblia DINP protein human, muc B family 0.002 0.0115 0.025
Trichomonas vaginalis CAMK family protein kinase 0.0186 0.2216 1
Echinococcus multilocularis tumor susceptibility gene 101 protein 0.0206 0.2465 0.2464
Mycobacterium tuberculosis UDP-galactopyranose mutase Glf (UDP-GALP mutase) (NAD+-flavin adenine dinucleotide-requiring enzyme) 0.0572 0.7076 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0127 0.0133
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0092 0.1028 0.1089
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0014 0.0043 0.0081
Loa Loa (eye worm) hypothetical protein 0.0021 0.0127 0.0133
Brugia malayi Ets-domain containing protein 0.0143 0.1668 0.1767
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.1029 0.4577
Mycobacterium tuberculosis Class a beta-lactamase BlaC 0.0391 0.4792 0.6744
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0115 0.0215
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.03 0.1247
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.011 0.1248 0.1322
Loa Loa (eye worm) hypothetical protein 0.0206 0.2465 0.2613
Schistosoma mansoni hypothetical protein 0.017 0.201 0.3766
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.011 0.1248 0.5507
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0489 0.0517
Onchocerca volvulus Hydroxyacylglutathione hydrolase, mitochondrial homolog 0.0016 0.0061 0.0064
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0115 0.0215
Trypanosoma cruzi metallo-beta-lactamase-like protein, putative 0.0016 0.0061 0.0017
Schistosoma mansoni kinase 0.0095 0.106 0.1987
Loa Loa (eye worm) hypothetical protein 0.0034 0.0291 0.0308
Echinococcus granulosus protein C ets 2 0.0021 0.0127 0.0133
Schistosoma mansoni ets 0.0021 0.0127 0.0238
Schistosoma mansoni hypothetical protein 0.0021 0.0127 0.0238
Brugia malayi Ets-domain containing protein 0.0143 0.1668 0.1767
Brugia malayi MH1 domain containing protein 0.0013 0.0034 0.0034
Echinococcus multilocularis GA binding protein alpha chain 0.0143 0.1668 0.1667
Schistosoma mansoni hypothetical protein 0.0187 0.2223 0.4164
Brugia malayi jmjC domain containing protein 0.0064 0.0676 0.0715
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0063 0.0065
Echinococcus granulosus smad 0.0024 0.017 0.0178
Schistosoma mansoni gabp alpha 0.0143 0.1668 0.3125
Leishmania major hypothetical protein, conserved 0.0066 0.0697 0.2962
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0115 0.0077
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0186 0.2216 0.2349
Loa Loa (eye worm) jmjC domain-containing protein 0.0015 0.0057 0.0059
Trichomonas vaginalis hypothetical protein 0.01 0.1132 0.5045
Echinococcus multilocularis mothers against decapentaplegic 5 0.0024 0.017 0.0168
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0115 0.012
Loa Loa (eye worm) hypothetical protein 0.0015 0.0057 0.0059
Leishmania major hypothetical protein, conserved 0.0016 0.0061 0.0017
Brugia malayi TAR-binding protein 0.0065 0.0691 0.0731
Onchocerca volvulus 0.0016 0.0061 0.0064
Trypanosoma cruzi hydroxyacylglutathione hydrolase, putative 0.0016 0.0061 0.0017
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0115 0.012
Trypanosoma brucei hydroxyacylglutathione hydrolase, putative 0.0016 0.0061 0.0107
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0071 0.0761 0.076
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Brugia malayi serine/threonine-protein kinase plk-2 0.0186 0.2216 0.2349
Echinococcus multilocularis kelch ECH associated protein 1 0.0186 0.2216 0.2215
Toxoplasma gondii histone lysine methyltransferase SET1 0.0112 0.1282 1
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0115 0.0114
Onchocerca volvulus Huntingtin homolog 0.0119 0.1364 0.1463
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0489 0.0517
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Toxoplasma gondii aldehyde dehydrogenase 0.0066 0.0692 0.5185
Trichomonas vaginalis beta lactamase domain, putative 0.0016 0.0061 0.0153
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.1028 0.1927
Trichomonas vaginalis apoptosis inducing factor, putative 0.0016 0.0061 0.0153
Schistosoma mansoni polyomavirus enhancer activator 3 pea3 0.0021 0.0127 0.0238
Schistosoma mansoni hypothetical protein 0.0016 0.0063 0.0117
Brugia malayi ethe1-prov protein 0.0016 0.0061 0.0063
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0066 0.0692 0.0691
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0691 0.1294
Brugia malayi RNA binding protein 0.0065 0.0691 0.0731
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0244 0.2942 0.3119
Loa Loa (eye worm) hypothetical protein 0.0016 0.0061 0.0063
Plasmodium falciparum cytosolic glyoxalase II 0.0016 0.0061 1
Brugia malayi hypothetical protein 0.0229 0.2758 0.2924
Trichomonas vaginalis conserved hypothetical protein 0.0016 0.0061 0.0153
Loa Loa (eye worm) hypothetical protein 0.0016 0.0061 0.0063
Leishmania major metallo-beta-lactamase family-like protein 0.0016 0.0061 0.0017
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0691 0.0731
Echinococcus granulosus tar DNA binding protein 0.0065 0.0691 0.0731
Echinococcus granulosus metallo beta lactamase domain containing protein 0.0016 0.0061 0.0063
Trypanosoma cruzi UEV domain/Zinc finger, C3HC4 type (RING finger), putative 0.0034 0.03 0.1126
Echinococcus granulosus mixed lineage leukemia protein mll 0.0014 0.0043 0.0044
Echinococcus granulosus fetal alzheimer antigen falz 0.005 0.0499 0.0527
Echinococcus granulosus jumonji domain containing 1A 0.0015 0.0057 0.0059
Loa Loa (eye worm) hypothetical protein 0.011 0.1248 0.1322
Echinococcus granulosus TGF beta signal transducer SmadC 0.0024 0.017 0.0178
Brugia malayi MH1 domain containing protein 0.0024 0.017 0.0178
Echinococcus granulosus ETHE1 protein 0.0016 0.0061 0.0063
Schistosoma mansoni jumonji/arid domain-containing protein 0.0064 0.0676 0.1266
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0115 0.012
Loa Loa (eye worm) hypothetical protein 0.0147 0.1724 0.1827
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Loa Loa (eye worm) hypothetical protein 0.0016 0.0061 0.0063
Echinococcus multilocularis muscleblind protein 0.0758 0.943 0.943
Echinococcus granulosus GPCR family 2 0.0016 0.0063 0.0065
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0037 0.0329 0.0328
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0115 0.0353
Trypanosoma cruzi ISWI complex protein 0.0032 0.0267 0.0973
Echinococcus granulosus dna polymerase eta 0.002 0.0115 0.012
Echinococcus multilocularis neuropeptide receptor A26 0.0479 0.5908 0.5907
Entamoeba histolytica hypothetical protein 0.0071 0.0761 0.3433

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) Agonist activity at mouse BRS3 relative to [D-Tyr6,b-Ala11,Phe13,Nle14]-Bombesin ChEMBL. 20347296
Activity (functional) = 94 % Agonist activity at human BRS3 relative to [D-Tyr6,b-Ala11,Phe13,Nle14]-Bombesin ChEMBL. 20347296
EC50 (functional) Agonist activity at mouse BRS3 ChEMBL. 20347296
EC50 (functional) = 1767 nM Agonist activity at human BRS3 ChEMBL. 20347296
IC50 (binding) = 287 nM Binding affinity to human BRS3 ChEMBL. 20347296

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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