Detailed information for compound 435244

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 446.542 | Formula: C17H26N4O6S2
  • H donors: 4 H acceptors: 6 LogP: -3.07 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: C[C@H](C1C(=O)N2C1[C@@H](C)C(=C2C(=O)O)S[C@@H]1CN[C@@H](C1)CN1CCNS1(=O)=O)O
  • InChi: 1S/C17H26N4O6S2/c1-8-13-12(9(2)22)16(23)21(13)14(17(24)25)15(8)28-11-5-10(18-6-11)7-20-4-3-19-29(20,26)27/h8-13,18-19,22H,3-7H2,1-2H3,(H,24,25)/t8-,9-,10+,11+,12?,13?/m1/s1
  • InChiKey: UVQRJYKOQNDZDY-CIWYLYRISA-N  


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
Mycobacterium tuberculosis Probable L-lysine-epsilon aminotransferase Lat (L-lysine aminotransferase) (lysine 6-aminotransferase) 0.0023 0.0276 0.0705
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0036 0.0522 0.0578
Schistosoma mansoni cpg binding protein 0.0036 0.0522 0.0563
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Schistosoma mansoni ap endonuclease 0.0012 0.0077 0.0068
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Schistosoma mansoni hypothetical protein 0.0079 0.1355 0.149
Plasmodium vivax hypothetical protein, conserved 0.0019 0.0207 0.7496
Giardia lamblia PHD finger protein 15 0.0019 0.0207 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0102 0.1785 0.1969
Loa Loa (eye worm) CXXC zinc finger family protein 0.0034 0.0485 0.23
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0171 0.0189
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0017 0.0171 0.0173
Loa Loa (eye worm) PHD-finger family protein 0.0019 0.0207 0.0936
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0037 0.0542 0.0601
Loa Loa (eye worm) steroid hormone receptor 0.0017 0.0171 0.0762
Echinococcus multilocularis peregrin 0.0019 0.0207 0.0205
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0013 0.0083 0.0091
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0013 0.0083 0.0331
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0017 0.0171 0.0173
Loa Loa (eye worm) hypothetical protein 0.0037 0.0542 0.2581
Brugia malayi mbt repeat family protein 0.0031 0.0439 0.2075
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0017 0.0171 0.0189
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0017 0.0171 0.0762
Echinococcus granulosus peregrin 0.0019 0.0207 0.0228
Loa Loa (eye worm) histone methyltransferase 0.001 0.004 0.0122
Echinococcus multilocularis ecdysone induced protein 78C 0.0017 0.0171 0.017
Schistosoma mansoni nuclear hormone receptor 0.0017 0.0171 0.0173
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0013 0.0083 0.0022
Brugia malayi F/Y-rich N-terminus family protein 0.0017 0.0157 0.0695
Mycobacterium ulcerans glutamate-1-semialdehyde aminotransferase 0.0023 0.0276 0.0705
Chlamydia trachomatis glutamate-1-semialdehyde-2,1-aminomutase 0.0023 0.0276 0.5
Brugia malayi exodeoxyribonuclease III family protein 0.0012 0.0077 0.0301
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0012 0.0077 0.2794
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0171 0.017
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0012 0.0077 0.0076
Echinococcus multilocularis histone acetyltransferase MYST2 0.0036 0.0522 0.052
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0017 0.0171 0.0189
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0017 0.0171 0.0762
Mycobacterium ulcerans acetylornithine aminotransferase 0.0023 0.0276 0.0705
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0017 0.0171 0.0762
Onchocerca volvulus Alhambra homolog 0.0019 0.0207 0.1133
Echinococcus multilocularis thyroid hormone receptor alpha 0.0017 0.0171 0.017
Leishmania major DNA polymerase eta, putative 0.0029 0.0402 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0063 0.1038 0.1036
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Loa Loa (eye worm) hypothetical protein 0.0036 0.0522 0.2481
Brugia malayi Bromodomain containing protein 0.0019 0.0207 0.0936
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0036 0.0522 0.052
Loa Loa (eye worm) latrophilin receptor protein 2 0.0037 0.0542 0.2581
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0037 0.0542 0.0541
Echinococcus granulosus SAM and MBT domain containing protein 0.0031 0.0439 0.0486
Brugia malayi ImpB/MucB/SamB family protein 0.0013 0.0083 0.0331
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0013 0.0083 0.0082
Brugia malayi Calcitonin receptor-like protein seb-1 0.0116 0.2056 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0012 0.0077 0.5
Schistosoma mansoni jumonji domain containing protein 0.005 0.0792 0.0863
Loa Loa (eye worm) hypothetical protein 0.0029 0.0402 0.1896
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0017 0.0171 0.0762
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0171 0.0762
Schistosoma mansoni jumonji/arid domain-containing protein 0.0025 0.032 0.0339
Toxoplasma gondii PHD-finger domain-containing protein 0.0019 0.0207 0.1318
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0017 0.0171 0.017
Echinococcus granulosus Aminotransferase class III 0.0023 0.0276 0.0305
Schistosoma mansoni jumonji/arid domain-containing protein 0.0025 0.032 0.0339
Loa Loa (eye worm) mbt repeat family protein 0.0031 0.0439 0.2075
Trypanosoma brucei unspecified product 0.0013 0.0083 0.1904
Brugia malayi Steroid receptor seven-up type 2 0.0017 0.0171 0.0762
Toxoplasma gondii PHD-finger domain-containing protein 0.0019 0.0207 0.1318
Schistosoma mansoni hypothetical protein 0.0037 0.0542 0.0586
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0037 0.0542 0.2581
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0017 0.0171 0.0762
Schistosoma mansoni retinoic acid receptor RXR 0.0017 0.0171 0.0173
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0023 0.0276 0.0705
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0171 0.0762
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0017 0.0171 0.0762
Schistosoma mansoni sex comb on midleg homolog 0.0031 0.0439 0.0471
Mycobacterium ulcerans DNA polymerase IV 0.0013 0.0083 0.0022
Schistosoma mansoni hypothetical protein 0.0193 0.3522 0.39
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0013 0.0083 0.0189
Schistosoma mansoni myelin transcription factor 1 myt1 0.0036 0.0522 0.0563
Plasmodium falciparum ornithine aminotransferase 0.0023 0.0276 1
Echinococcus multilocularis dnaJ subfamily B 0.0481 0.9005 0.9005
Schistosoma mansoni thyroid hormone receptor 0.0017 0.0171 0.0173
Brugia malayi nuclear hormone receptor 0.0017 0.0171 0.0762
Echinococcus multilocularis Aminotransferase class III 0.0023 0.0276 0.0274
Schistosoma mansoni hypothetical protein 0.0037 0.0542 0.0586
Schistosoma mansoni hypothetical protein 0.0037 0.0542 0.0586
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0017 0.0171 0.0762
Mycobacterium tuberculosis Conserved hypothetical protein 0.0013 0.0083 0.0022
Schistosoma mansoni coup transcription factor 0.0017 0.0171 0.0173
Echinococcus granulosus ecdysone induced protein 78C 0.0017 0.0171 0.0189
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0017 0.0171 0.0173
Toxoplasma gondii ornithine aminotransferase, mitochondrial precursor, putative 0.0023 0.0276 0.202
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0126 0.2244 0.2243
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0017 0.0171 0.017
Leishmania major DNA polymerase eta, putative 0.0021 0.0236 0.4874
Schistosoma mansoni hypothetical protein 0.0019 0.0207 0.0213
Echinococcus granulosus PHD finger protein rhinoceros 0.0019 0.0207 0.0228
Echinococcus multilocularis FTZ F1 alpha 0.0017 0.0171 0.017
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Schistosoma mansoni terminal deoxycytidyl transferase 0.0013 0.0083 0.0075
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0012 0.0077 0.2794
Echinococcus multilocularis dna polymerase kappa 0.0013 0.0083 0.0082
Schistosoma mansoni hypothetical protein 0.0481 0.9005 1
Echinococcus granulosus polycomb protein SCMH1 0.0031 0.0439 0.0486
Brugia malayi ImpB/MucB/SamB family protein 0.0029 0.0402 0.1896
Brugia malayi steroid hormone receptor 0.0017 0.0171 0.0762
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0012 0.0077 0.1747
Loa Loa (eye worm) jmjC domain-containing protein 0.004 0.0596 0.2843
Echinococcus multilocularis GPCR, family 2 0.0037 0.0542 0.0541
Trypanosoma cruzi DNA polymerase kappa, putative 0.0013 0.0083 0.0189
Echinococcus granulosus ornithine aminotransferase 0.0023 0.0276 0.0305
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0012 0.0077 0.0084
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0031 0.0439 0.8538
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0017 0.0171 0.0189
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Loa Loa (eye worm) hypothetical protein 0.0031 0.0439 0.2075
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0017 0.0171 0.0173
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0171 0.0762
Schistosoma mansoni RAR-like nuclear receptor 0.0017 0.0171 0.0173
Schistosoma mansoni cpg binding protein 0.0036 0.0522 0.0563
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0017 0.0171 0.017
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Brugia malayi Latrophilin receptor protein 2 0.0037 0.0542 0.2581
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Giardia lamblia DINP protein human, muc B family 0.0013 0.0083 0.0475
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0171 0.0762
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0102 0.1785 0.1981
Echinococcus multilocularis dna polymerase eta 0.0029 0.0402 0.0401
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0102 0.1785 0.8674
Loa Loa (eye worm) hypothetical protein 0.0019 0.0207 0.0936
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0017 0.0171 0.0173
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0037 0.0542 0.0541
Loa Loa (eye worm) hypothetical protein 0.0033 0.0468 0.2215
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0021 0.0236 0.1612
Brugia malayi PHD-finger family protein 0.0019 0.0207 0.0936
Entamoeba histolytica deoxycytidyl transferase, putative 0.0013 0.0083 1
Mycobacterium tuberculosis Probable aminotransferase 0.016 0.2896 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0116 0.2056 1
Echinococcus granulosus cpg binding protein 0.0036 0.0522 0.0578
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0031 0.0439 0.0471
Echinococcus granulosus jumonji domain containing protein 0.0027 0.035 0.0387
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Mycobacterium tuberculosis Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA 0.016 0.2896 1
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0013 0.0083 0.0075
Plasmodium vivax ornithine aminotransferase, putative 0.0023 0.0276 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0126 0.2244 0.2491
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0017 0.0171 0.0762
Schistosoma mansoni thyroid hormone receptor 0.0017 0.0171 0.0173
Trypanosoma cruzi DNA polymerase kappa, putative 0.0013 0.0083 0.0189
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0017 0.0171 0.0762
Echinococcus multilocularis ornithine aminotransferase 0.0023 0.0276 0.0274
Echinococcus multilocularis lysine specific demethylase 5A 0.0023 0.0283 0.0282
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0017 0.0171 0.0762
Trypanosoma cruzi DNA polymerase eta, putative 0.0021 0.0236 0.4874
Loa Loa (eye worm) jmjC domain-containing protein 0.0025 0.032 0.1493
Mycobacterium tuberculosis Probable glutamate-1-semialdehyde 2,1-aminomutase HemL (GSA) (glutamate-1-semialdehyde aminotransferase) (GSA-at) 0.0023 0.0276 0.0705
Trypanosoma brucei DNA polymerase IV, putative 0.0013 0.0083 0.1904
Echinococcus granulosus lysine specific demethylase 5A 0.0025 0.032 0.0354
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0013 0.0083 0.0022
Schistosoma mansoni steroid hormone receptor ad4bp 0.0017 0.0171 0.0173
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Trypanosoma brucei DNA polymerase IV, putative 0.0013 0.0083 0.1904
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0017 0.0171 0.017
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0019 0.0207 0.0213
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0102 0.1785 0.1981
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0009 0.0016 0.0016
Trypanosoma cruzi DNA polymerase kappa, putative 0.0013 0.0083 0.0189
Onchocerca volvulus 0.0034 0.0485 1
Wolbachia endosymbiont of Brugia malayi acetylornithine transaminase protein 0.0023 0.0276 1
Leishmania major DNA polymerase kappa, putative 0.0013 0.0083 0.0189
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0102 0.1785 0.1969
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0015 0.0121 0.0117
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0072 0.1206 0.1324
Mycobacterium ulcerans ornithine aminotransferase RocD1 and RocD2 0.0023 0.0276 0.0705
Echinococcus multilocularis polycomb protein SCMH1 0.0031 0.0439 0.0438
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0102 0.1785 0.1784
Echinococcus granulosus dna polymerase eta 0.0029 0.0402 0.0445
Brugia malayi jmjC domain containing protein 0.0025 0.032 0.1493
Echinococcus granulosus dnaJ subfamily B 0.0481 0.9005 1
Brugia malayi mbt repeat family protein 0.0031 0.0439 0.2075
Schistosoma mansoni sex comb on midleg homolog 0.0031 0.0439 0.0471
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0017 0.0171 0.0173
Loa Loa (eye worm) hypothetical protein 0.0017 0.0171 0.0762
Mycobacterium tuberculosis Probable acetylornithine aminotransferase ArgD 0.0023 0.0276 0.0705
Echinococcus multilocularis ornithine aminotransferase 0.0023 0.0276 0.0274
Plasmodium falciparum phd finger protein, putative 0.0019 0.0207 0.7496
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0017 0.0171 0.0762
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0116 0.2056 1
Echinococcus multilocularis jumonji domain containing protein 0.0027 0.035 0.0348
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.004 0.0044
Mycobacterium tuberculosis Probable ornithine aminotransferase (N-terminus part) RocD1 (ornithine--oxo-acid aminotransferase) 0.0023 0.0276 0.0705
Brugia malayi nuclear receptor NHR-88 0.0017 0.0171 0.0762
Brugia malayi CXXC zinc finger family protein 0.0034 0.0485 0.23
Mycobacterium ulcerans adenosylmethionine-8-amino-7-oxononanoate aminotransferase 0.016 0.2896 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.004 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0017 0.0171 0.0762
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Schistosoma mansoni hypothetical protein 0.0037 0.0542 0.0586
Trichomonas vaginalis DNA polymerase eta, putative 0.0013 0.0083 0.0022
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0012 0.0077 0.0301
Brugia malayi jmjC domain containing protein 0.0063 0.1038 0.5009
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0171 0.017
Trypanosoma cruzi DNA polymerase kappa, putative 0.0013 0.0083 0.0189
Trichomonas vaginalis acetylornithine aminotransferase, putative 0.016 0.2896 1
Trypanosoma brucei DNA polymerase eta, putative 0.0029 0.0402 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0017 0.0171 0.0762
Loa Loa (eye worm) hypothetical protein 0.0116 0.2056 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0063 0.1038 0.1151
Onchocerca volvulus 0.0031 0.0439 0.8538
Echinococcus granulosus histone acetyltransferase MYST2 0.0036 0.0522 0.0578
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0102 0.1785 0.8674
Echinococcus granulosus dna polymerase kappa 0.0013 0.0083 0.0091
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0036 0.0522 0.2481
Loa Loa (eye worm) MBCTL1 0.0036 0.0522 0.2481
Mycobacterium ulcerans DNA polymerase IV 0.0013 0.0083 0.0022
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0017 0.0171 0.0762
Schistosoma mansoni DNA polymerase eta 0.0029 0.0402 0.043
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0017 0.0171 0.0762
Brugia malayi 4-aminobutyrate aminotransferase, mitochondrial precursor 0.0023 0.0276 0.1275
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0102 0.1785 0.1784
Mycobacterium leprae PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA 0.016 0.2896 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.1355 0.6566
Trypanosoma brucei DNA polymerase IV, putative 0.0013 0.0083 0.1904
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0102 0.1785 0.1969
Brugia malayi photoreceptor-specific nuclear receptor 0.0017 0.0171 0.0762
Echinococcus granulosus FTZ F1 alpha 0.0017 0.0171 0.0189
Mycobacterium ulcerans L-lysine aminotransferase 0.0023 0.0276 0.0705
Echinococcus multilocularis SAM and MBT domain containing protein 0.0031 0.0439 0.0438
Echinococcus multilocularis cpg binding protein 0.0036 0.0522 0.052
Schistosoma mansoni ornithine--oxo-acid transaminase 0.0023 0.0276 0.0289
Brugia malayi ecdysteroid receptor 0.0017 0.0171 0.0762
Schistosoma mansoni cpg binding protein 0.0034 0.0485 0.0522
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0017 0.0171 0.0762
Echinococcus granulosus GPCR family 2 0.0037 0.0542 0.0601
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0017 0.0171 0.0762
Mycobacterium ulcerans hypothetical protein 0.016 0.2896 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0019 0.0207 0.0205
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0017 0.0171 0.0189
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0083 0.1904
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0171 0.0189
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0017 0.0171 0.0189
Toxoplasma gondii histone lysine methyltransferase SET1 0.0064 0.106 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0037 0.0542 0.0601
Schistosoma mansoni ap endonuclease 0.0012 0.0077 0.0068
Trypanosoma cruzi DNA polymerase eta, putative 0.0029 0.0402 1
Brugia malayi latrophilin 2 splice variant baaae 0.0079 0.1355 0.6566
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0009 0.0016 0.0014
Mycobacterium ulcerans 4-aminobutyrate aminotransferase 0.0023 0.0276 0.0705

Activities

Activity type Activity value Assay description Source Reference
MIC (functional) = 0.01 ug ml-1 Antibacterial activity against Streptococcus pyogenes 9889 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.02 ug ml-1 Antibacterial activity against Streptococcus agalactiae 32 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.02 ug ml-1 Antibacterial activity against Streptococcus pneumoniae 0025 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Escherichia coli 04 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Klebsiella pneumoniae 523 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Citrobacter freundii 323 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Enterobacter cloacae 34 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Serratia marcescens 3349 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.049 ug ml-1 Antibacterial activity against Escherichia coli 04 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.098 ug ml-1 Antibacterial activity against coagulase negative Staphylococcus after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 0.781 ug ml-1 Antibacterial activity against Pseudomonas aeruginosa 5455 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 3.12 ug ml-1 Antibacterial activity against Staphylococcus aureus 1218 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 6.25 ug ml-1 Antibacterial activity against Enterococcus faecalis 2347 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 6.25 ug ml-1 Antibacterial activity against Haemophilus influenzae 1210 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453
MIC (functional) = 12.5 ug ml-1 Antibacterial activity against Acinetobacter baumannii 2289 after 18 to 24 hrs by agar dilution method ChEMBL. 17418453

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.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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