Detailed information for compound 1698833

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 1400.73 | Formula: C72H101N15O12S
  • H donors: 12 H acceptors: 11 LogP: 4.17 Rotable bonds: 51
    Rule of 5 violations (Lipinski): 4
  • SMILES: NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)OC)CCSC)CC(C)C)Cc1ccccc1)Cc1ccccc1)Cc1ccccc1)Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)N
  • InChi: 1S/C72H101N15O12S/c1-46(2)40-54(63(90)81-53(34-39-100-4)71(98)99-3)79-61(88)45-78-62(89)55(41-47-22-9-5-10-23-47)82-64(91)56(42-48-24-11-6-12-25-48)83-65(92)57(43-49-26-13-7-14-27-49)84-66(93)58(44-50-28-15-8-16-29-50)85-68(95)60-33-21-38-87(60)70(97)52(31-17-18-35-73)80-67(94)59-32-20-37-86(59)69(96)51(74)30-19-36-77-72(75)76/h5-16,22-29,46,51-60H,17-21,30-45,73-74H2,1-4H3,(H,78,89)(H,79,88)(H,80,94)(H,81,90)(H,82,91)(H,83,92)(H,84,93)(H,85,95)(H4,75,76,77)/t51-,52-,53+,54-,55-,56-,57-,58+,59-,60-/m0/s1
  • InChiKey: OHMQENBZSQULKC-LYQKQMONSA-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
Echinococcus granulosus transient receptor potential cation channel 0.0004 0.0006 0.0006
Brugia malayi Isocitrate dehydrogenase 0.0011 0.0181 0.0274
Trichomonas vaginalis hypothetical protein 0.0004 0.0012 0.0018
Trypanosoma cruzi DNA polymerase kappa, putative 0.0014 0.026 0.3098
Echinococcus multilocularis dnaJ subfamily B 0.0402 1 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0011 0.0181 0.207
Schistosoma mansoni cpg binding protein 0.003 0.0663 0.0663
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0011 0.0181 0.0181
Schistosoma mansoni DNA polymerase IV / kappa 0.0004 0.0022 0.0022
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.022 0.5432 0.8538
Plasmodium vivax importin-beta 2, putative 0.0021 0.0431 0.5376
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Trypanosoma cruzi DNA polymerase eta, putative 0.0032 0.0717 0.9028
Loa Loa (eye worm) Smad1 0.0005 0.0051 0.0081
Leishmania major DNA polymerase kappa, putative 0.0014 0.026 0.3183
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0011 0.0181 0.2168
Trypanosoma brucei importin beta-1 subunit, putative 0.0021 0.0431 0.5376
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0011 0.0181 0.207
Trypanosoma brucei DNA polymerase IV, putative 0.0014 0.026 0.3183
Trichomonas vaginalis helicase, putative 0.0006 0.0075 0.0117
Brugia malayi 3'-5' exonuclease family protein 0.0004 0.0024 0.0028
Onchocerca volvulus Glucosylceramidase homolog 0.0169 0.4145 1
Schistosoma mansoni importin beta-1 0.0021 0.0431 0.0431
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0029 0.0648 0.8162
Echinococcus granulosus dna polymerase eta 0.0032 0.0717 0.0717
Mycobacterium ulcerans DNA polymerase IV 0.0014 0.026 0.0379
Schistosoma mansoni hypothetical protein 0.022 0.5432 0.5432
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Brugia malayi Importin beta-1 subunit 0.0021 0.0431 0.0668
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.1056 0.166
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Echinococcus granulosus Helicase RNase D C terminal HRDC domain 0.0004 0.0024 0.0024
Entamoeba histolytica hypothetical protein 0.005 0.1166 1
Echinococcus multilocularis isocitrate dehydrogenase 0.0011 0.0181 0.0181
Leishmania major DNA polymerase eta, putative 0.0032 0.0717 0.904
Leishmania major GTP-binding protein, putative 0.0015 0.0295 0.3625
Schistosoma mansoni smad 0.0005 0.0051 0.0051
Echinococcus multilocularis dna polymerase eta 0.0032 0.0717 0.0717
Mycobacterium tuberculosis Probable NADH dehydrogenase I (chain H) NuoH (NADH-ubiquinone oxidoreductase chain H) 0.0159 0.391 0.6031
Entamoeba histolytica Ran family GTPase 0.0015 0.0295 0.2448
Schistosoma mansoni DNA helicase recq1 0.0014 0.0259 0.0259
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.009 0.009
Schistosoma mansoni smad1 5 8 and 0.0005 0.0051 0.0051
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Trypanosoma brucei unspecified product 0.0014 0.026 0.3183
Trypanosoma brucei unspecified product 0.001 0.0153 0.1806
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0015 0.0295 0.3546
Leishmania major hypothetical protein, conserved 0.0035 0.0791 1
Brugia malayi polk-prov protein 0.0004 0.0022 0.0024
Mycobacterium ulcerans proteasome PrcA 0.0262 0.6473 1
Trichomonas vaginalis ran, putative 0.0015 0.0295 0.0463
Echinococcus granulosus importin subunit beta 1 0.0021 0.0431 0.0431
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0015 0.0295 0.3625
Loa Loa (eye worm) hypothetical protein 0.0049 0.1143 0.1797
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0015 0.0295 0.0295
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0004 0.0022 0.0077
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0014 0.026 0.3183
Schistosoma mansoni ran 0.0015 0.0295 0.0295
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0015 0.0295 0.3546
Schistosoma mansoni hypothetical protein 0.0016 0.0303 0.0303
Brugia malayi NADH dehydrogenase subunit 1 0.0043 0.099 0.1547
Treponema pallidum ATP-dependent DNA helicase 0.0007 0.009 0.5
Entamoeba histolytica hypothetical protein 0.005 0.1166 1
Loa Loa (eye worm) NADH dehydrogenase subunit 1 0.0043 0.099 0.1556
Trypanosoma cruzi DNA polymerase eta, putative 0.0023 0.0478 0.593
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0007 0.009 0.0889
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0022 0.0472 0.3702
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0622 0.0978
Echinococcus multilocularis Helicase RNase D C terminal, HRDC domain 0.0004 0.0024 0.0024
Schistosoma mansoni Smad4 0.0005 0.0051 0.0051
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Schistosoma mansoni DNA polymerase eta 0.0032 0.0717 0.0717
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0011 0.0181 0.0181
Schistosoma mansoni hypothetical protein 0.0159 0.391 0.391
Mycobacterium ulcerans NADH dehydrogenase subunit H 0.0159 0.391 0.6031
Brugia malayi hypothetical protein 0.0023 0.0481 0.0746
Entamoeba histolytica recQ family helicase, putative 0.0007 0.0083 0.0618
Leishmania major DNA damage repair protein, putative 0.0004 0.0022 0.0123
Schistosoma mansoni NADH dehydrogenase subunit 1 0.0043 0.099 0.099
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0004 0.0016 0.0048
Schistosoma mansoni hypothetical protein 0.0016 0.0308 0.0308
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0017 0.0333 0.0523
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0133 0.0209
Trypanosoma brucei hypothetical protein, conserved 0.0004 0.0022 0.0123
Trypanosoma cruzi PAB1-binding protein , putative 0.0035 0.0791 1
Trypanosoma brucei PAB1-binding protein , putative 0.0035 0.0791 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0717 0.1126
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Giardia lamblia Sgs1 DNA helicase, putative 0.0014 0.0259 0.8701
Brugia malayi Smad1 0.0005 0.0051 0.0071
Schistosoma mansoni hypothetical protein 0.0235 0.5812 0.5812
Brugia malayi MH1 domain containing protein 0.0005 0.0051 0.0071
Loa Loa (eye worm) MH2 domain-containing protein 0.008 0.193 0.3033
Brugia malayi ImpB/MucB/SamB family protein 0.0014 0.026 0.0399
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1056 0.1056
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0257 0.6362 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0014 0.0259 0.317
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0018 0.0361 0.4403
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0014 0.0259 0.0259
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.4372 0.6873
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0303 0.0476
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Echinococcus granulosus GPCR family 2 0.0016 0.0303 0.0303
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.1056 0.1652
Mycobacterium ulcerans DNA polymerase IV 0.0014 0.026 0.0379
Mycobacterium tuberculosis Conserved hypothetical alanine rich protein 0.0004 0.0024 0.0013
Mycobacterium ulcerans formate hydrogenlyase HycD 0.0043 0.099 0.1509
Trichomonas vaginalis DNA helicase recq, putative 0.0033 0.075 0.1178
Loa Loa (eye worm) hypothetical protein 0.0016 0.0303 0.0476
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0014 0.026 0.0408
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0011 0.0181 0.0181
Trypanosoma brucei DNA damage repair protein, putative 0.0004 0.0022 0.0123
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0018 0.0361 0.4472
Loa Loa (eye worm) isocitrate dehydrogenase 0.0011 0.0181 0.0284
Loa Loa (eye worm) RNA binding protein 0.0088 0.2119 0.3331
Wolbachia endosymbiont of Brugia malayi NADH dehydrogenase subunit H 0.0159 0.391 0.5
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0014 0.026 0.026
Brugia malayi hypothetical protein 0.0035 0.0791 0.1235
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Trypanosoma brucei DNA polymerase kappa, putative 0.001 0.0153 0.1806
Schistosoma mansoni hypothetical protein 0.0016 0.0303 0.0303
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.0075 0.0117
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0015 0.0295 1
Echinococcus granulosus transportin 1 0.0004 0.0012 0.0012
Entamoeba histolytica hypothetical protein 0.005 0.1166 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0015 0.0295 0.3625
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1056 0.1056
Trichomonas vaginalis DNA helicase recq, putative 0.0018 0.0361 0.0566
Trypanosoma brucei DNA polymerase kappa, putative 0.001 0.0153 0.1806
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0023 0.0478 0.3748
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Loa Loa (eye worm) hypothetical protein 0.0004 0.0006 0.001
Trypanosoma brucei ribosomal RNA processing protein 6 0.0004 0.0024 0.0158
Echinococcus multilocularis transient receptor potential cation channel 0.0004 0.0006 0.0006
Schistosoma mansoni tar DNA-binding protein 0.0088 0.2119 0.2119
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Toxoplasma gondii isocitrate dehydrogenase 0.0011 0.0181 0.1358
Toxoplasma gondii LsmAD domain-containing protein 0.0035 0.0791 0.6267
Echinococcus granulosus TGF beta signal transducer SmadC 0.0005 0.0051 0.0051
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0014 0.0259 0.0259
Mycobacterium tuberculosis Proteasome alpha subunit PrcA; assembles with beta subunit PrcB. 0.0262 0.6473 1
Trypanosoma brucei unspecified product 0.001 0.0153 0.1806
Brugia malayi NADH dehydrogenase subunit 1, identical 0.0043 0.099 0.1547
Brugia malayi RNA binding protein 0.0088 0.2119 0.3324
Entamoeba histolytica hypothetical protein 0.005 0.1166 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0791 0.1244
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.013 0.0195
Entamoeba histolytica deoxycytidyl transferase, putative 0.0014 0.026 0.215
Schistosoma mansoni transcription factor LCR-F1 0.005 0.1166 0.1166
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1056 0.1056
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0015 0.0295 0.3625
Plasmodium falciparum DNA repair protein REV1, putative 0.0004 0.0022 0.0123
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0011 0.0181 0.2168
Onchocerca volvulus 0.0043 0.099 0.1043
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0303 0.0303
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0004 0.0022 0.0077
Loa Loa (eye worm) transcription factor SMAD2 0.008 0.193 0.3033
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0014 0.0259 0.0397
Loa Loa (eye worm) importin-beta domain-containing protein 0.0004 0.0012 0.0019
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0133 0.0133
Echinococcus granulosus cpg binding protein 0.003 0.0663 0.0663
Schistosoma mansoni tar DNA-binding protein 0.0088 0.2119 0.2119
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0303 0.0467
Schistosoma mansoni transient receptor potential channel 0.0004 0.0006 0.0006
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.009 0.009
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Plasmodium vivax exosome complex exonuclease RRP6, putative 0.0004 0.0024 0.0158
Trypanosoma cruzi DNA polymerase kappa, putative 0.0014 0.026 0.3098
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0016 0.0308 0.0308
Plasmodium falciparum ataxin-2 like protein, putative 0.0035 0.0791 1
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.009 0.009
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0003 0 0.00000000022356
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0011 0.0181 0.0256
Plasmodium vivax DNA repair protein REV1, putative 0.0004 0.0022 0.0123
Trypanosoma cruzi importin beta-1 subunit, putative 0.0017 0.0333 0.4049
Toxoplasma gondii HEAT repeat-containing protein 0.0021 0.0431 0.3369
Schistosoma mansoni hypothetical protein 0.0034 0.0754 0.0754
Echinococcus granulosus geminin 0.0235 0.5812 0.5812
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0015 0.0295 0.0453
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Toxoplasma gondii 3'-5' exonuclease domain-containing protein 0.0004 0.0024 0.0099
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0303 0.0303
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Schistosoma mansoni tar DNA-binding protein 0.0088 0.2119 0.2119
Leishmania major importin beta-1 subunit, putative 0.0017 0.0333 0.4122
Brugia malayi RNA, U transporter 1 0.0059 0.1384 0.2167
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.009 0.009
Echinococcus granulosus snurportin 1 0.022 0.5432 0.5432
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Echinococcus granulosus smad 0.0005 0.0051 0.0051
Schistosoma mansoni blooms syndrome DNA helicase 0.0026 0.0574 0.0574
Echinococcus granulosus NADH dehydrogenase subunit 1 0.0159 0.391 0.391
Echinococcus multilocularis dna polymerase kappa 0.0014 0.026 0.026
Entamoeba histolytica exosome component 10, putative 0.0004 0.0024 0.0107
Echinococcus multilocularis short transient receptor potential channel 6 0.0004 0.0006 0.0006
Echinococcus multilocularis cpg binding protein 0.003 0.0663 0.0663
Schistosoma mansoni tar DNA-binding protein 0.0088 0.2119 0.2119
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0014 0.026 0.026
Brugia malayi ImpB/MucB/SamB family protein 0.0032 0.0717 0.1117
Echinococcus granulosus short transient receptor potential channel 6 0.0004 0.0006 0.0006
Brugia malayi MH2 domain containing protein 0.0005 0.0051 0.0071
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0007 0.009 0.0889
Schistosoma mansoni hypothetical protein 0.0016 0.0303 0.0303
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0088 0.2119 0.3331
Schistosoma mansoni ran 0.0015 0.0295 0.0295
Mycobacterium tuberculosis Conserved hypothetical protein 0.0014 0.026 0.0379
Brugia malayi MH2 domain containing protein 0.0005 0.0051 0.0071
Loa Loa (eye worm) hypothetical protein 0.0021 0.0431 0.0677
Trypanosoma brucei importin beta-1 subunit, putative 0.0021 0.0431 0.5376
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0011 0.0181 0.0181
Schistosoma mansoni hypothetical protein 0.005 0.1166 0.1166
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0014 0.0259 0.0397
Trypanosoma brucei chrX additional, unordered contigs 0.0004 0.0022 0.0123
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Loa Loa (eye worm) MH1 domain-containing protein 0.0005 0.0051 0.0081
Schistosoma mansoni cpg binding protein 0.003 0.0663 0.0663
Entamoeba histolytica hypothetical protein 0.0017 0.0333 0.2783
Trypanosoma brucei DNA polymerase IV, putative 0.0014 0.026 0.3183
Echinococcus granulosus importin 5 0.0004 0.0012 0.0012
Trypanosoma brucei DNA damage repair protein, putative 0.0004 0.0022 0.0123
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0005 0.0051 0.0051
Brugia malayi MH1 domain containing protein 0.0005 0.0051 0.0071
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1056 0.1056
Plasmodium vivax ataxin-2 like protein, putative 0.0035 0.0791 1
Echinococcus granulosus translational activator gcn1 0.0004 0.0012 0.0012
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0.0075 0.0117
Loa Loa (eye worm) hypothetical protein 0.0034 0.0754 0.1186
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0014 0.026 0.0379
Echinococcus multilocularis bloom syndrome protein 0.0033 0.075 0.075
Trypanosoma cruzi ribosomal RNA processing protein 6, putative 0.0004 0.0024 0.0035
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.1256 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1143 0.1797
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0303 0.0303
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0005 0.0051 0.0051
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0011 0.0181 0.2168
Schistosoma mansoni tar DNA-binding protein 0.0088 0.2119 0.2119
Echinococcus multilocularis geminin 0.0235 0.5812 0.5812
Entamoeba histolytica recQ family DNA helicase 0.0007 0.009 0.0676
Echinococcus granulosus GTP binding nuclear protein Ran 0.0015 0.0295 0.0295
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.005 0.1166 0.1166
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.009 0.009
Trichomonas vaginalis importin beta-1, putative 0.0017 0.0333 0.0523
Leishmania major DNA polymerase eta, putative 0.0023 0.0478 0.598
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0014 0.026 0.0409
Mycobacterium leprae probable proteasome (alpha subunit) PrcA 0.0262 0.6473 1
Echinococcus multilocularis snurportin 1 0.022 0.5432 0.5432
Echinococcus multilocularis tar DNA binding protein 0.0088 0.2119 0.2119
Schistosoma mansoni hypothetical protein 0.0016 0.0303 0.0303
Trypanosoma cruzi DNA polymerase kappa, putative 0.0014 0.026 0.3098
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Giardia lamblia DINP protein human, muc B family 0.0014 0.026 0.8738
Echinococcus granulosus Smad4 0.0005 0.0051 0.0051
Schistosoma mansoni polymyositis/scleroderma autoantigen-related 0.0004 0.0024 0.0024
Schistosoma mansoni terminal deoxycytidyl transferase 0.0014 0.026 0.026
Leishmania major DNA polymerase kappa, putative 0.0004 0.0022 0.0123
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Loa Loa (eye worm) hypothetical protein 0.0168 0.412 0.6476
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0011 0.0181 0.0181
Brugia malayi kap beta 3 protein 0.0004 0.0012 0.0009
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0133 0.0133
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0007 0.009 0.0628
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0303 0.0467
Echinococcus granulosus mothers against decapentaplegic 5 0.0005 0.0051 0.0051
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0024 0.0038
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0017 0.0333 0.0523
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0014 0.0259 0.0259
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.1416 0.1416
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0011 0.0181 0.2168
Plasmodium vivax hypothetical protein, conserved 0.0004 0.0016 0.0048
Mycobacterium tuberculosis Possible formate hydrogenlyase HycD (FHL) 0.0043 0.099 0.1509
Trichomonas vaginalis DNA polymerase eta, putative 0.0014 0.026 0.0408
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Leishmania major exosome subunit rrp6p homologue, putative 0.0004 0.0024 0.0158
Echinococcus granulosus bloom syndrome protein 0.0033 0.075 0.075
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0011 0.0181 0.2168
Trypanosoma brucei DNA polymerase kappa, putative 0.0004 0.0022 0.0123
Brugia malayi hypothetical protein 0.005 0.1166 0.1825
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0015 0.0295 0.0463
Brugia malayi MH2 domain containing protein 0.008 0.193 0.3026
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1056 0.1056
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0023 0.0479 0.5993
Toxoplasma gondii isocitrate dehydrogenase 0.0011 0.0181 0.1358
Trypanosoma brucei DNA polymerase eta, putative 0.0032 0.0717 0.904
Onchocerca volvulus 0.0043 0.099 0.1043
Trichomonas vaginalis conserved hypothetical protein 0.0004 0.0016 0.0024
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Brugia malayi Bloom's syndrome protein homolog 0.0033 0.075 0.1169
Schistosoma mansoni cpg binding protein 0.0028 0.0622 0.0622
Echinococcus multilocularis translational activator gcn1 0.0004 0.0012 0.0012
Loa Loa (eye worm) RecQ helicase 0.0033 0.075 0.1178
Trypanosoma brucei DNA polymerase IV, putative 0.0014 0.026 0.3183
Echinococcus multilocularis importin subunit beta 1 0.0021 0.0431 0.0431
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0015 0.0295 0.2272
Echinococcus multilocularis mothers against decapentaplegic 5 0.0005 0.0051 0.0051
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0018 0.0361 0.4472
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0.0075 0.0117
Echinococcus multilocularis GPCR, family 2 0.0016 0.0303 0.0303
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0303 0.0303
Trypanosoma brucei hypothetical protein, conserved 0.0004 0.0022 0.0123
Trypanosoma cruzi PAB1-binding protein , putative 0.0035 0.0791 1
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0257 0.6362 1
Echinococcus multilocularis transient receptor potential cation channel 0.0004 0.0006 0.0006
Loa Loa (eye worm) MH2 domain-containing protein 0.0005 0.0051 0.0081
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0014 0.0259 0.1987
Plasmodium vivax ATP-dependent DNA helicase Q1, putative 0.0007 0.0083 0.0915
Loa Loa (eye worm) hypothetical protein 0.0007 0.009 0.0141
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Loa Loa (eye worm) TAR-binding protein 0.0088 0.2119 0.3331
Echinococcus granulosus tar DNA binding protein 0.0088 0.2119 0.2119
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0014 0.0259 0.0259
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1143 0.1789
Loa Loa (eye worm) 3'-5' exonuclease 0.0004 0.0024 0.0038
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0004 0.0016 0.0016
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0754 0.1177
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1056 0.1056
Echinococcus granulosus dna polymerase kappa 0.0014 0.026 0.026
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0011 0.0181 0.0181
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1056 0.1056
Trypanosoma brucei DNA polymerase kappa, putative 0.0004 0.0022 0.0123
Brugia malayi TAR-binding protein 0.0088 0.2119 0.3324
Schistosoma mansoni smad1 5 8 and 0.0005 0.0051 0.0051
Schistosoma mansoni smad1 5 8 and 0.0005 0.0051 0.0051
Trichomonas vaginalis DNA helicase recq1, putative 0.0033 0.075 0.1178
Trichomonas vaginalis glucosylceramidase, putative 0.0178 0.4372 0.6873
Brugia malayi CXXC zinc finger family protein 0.0028 0.0622 0.0969
Trichomonas vaginalis conserved hypothetical protein 0.0006 0.0075 0.0117
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0014 0.0259 0.1987
Trichomonas vaginalis glucosylceramidase, putative 0.0257 0.6362 1
Plasmodium falciparum importin beta, putative 0.0021 0.0431 0.5376
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0016 0.0308 0.0308
Schistosoma mansoni blooms syndrome DNA helicase 0.0007 0.009 0.009
Trypanosoma brucei DNA polymerase kappa, putative 0.001 0.0153 0.1806
Mycobacterium ulcerans hypothetical protein 0.0004 0.0024 0.0013
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0014 0.026 0.026
Echinococcus multilocularis smad 0.0005 0.0051 0.0051
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Schistosoma mansoni importin-beta 2 0.0004 0.0012 0.0012
Trichomonas vaginalis glucosylceramidase, putative 0.0169 0.4145 0.6515
Mycobacterium ulcerans hypothetical protein 0.0004 0.0022 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.026 0.3183
Schistosoma mansoni hypothetical protein 0.0235 0.5812 0.5812
Echinococcus multilocularis importin 5 0.0004 0.0012 0.0012
Brugia malayi isocitrate dehydrogenase 0.0011 0.0181 0.0274
Loa Loa (eye worm) hypothetical protein 0.0004 0.0022 0.0034
Brugia malayi hypothetical protein 0.0043 0.099 0.1547
Echinococcus multilocularis Smad4 0.0005 0.0051 0.0051
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0014 0.0259 0.0407
Trypanosoma cruzi DNA polymerase kappa, putative 0.0014 0.026 0.3098
Entamoeba histolytica recQ family helicase, putative 0.0018 0.0361 0.302
Brugia malayi RNA recognition motif domain containing protein 0.0088 0.2119 0.3324
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1143 0.1789
Schistosoma mansoni DNA helicase recq5 0.0014 0.0259 0.0259
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.005 0.1166 0.1166
Schistosoma mansoni hypothetical protein 0.0402 1 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0259 0.0407
Plasmodium falciparum ataxin-2 like protein, putative 0.0035 0.0791 1
Loa Loa (eye worm) kap beta 3 protein 0.0004 0.0012 0.0019
Echinococcus multilocularis transportin 1 0.0004 0.0012 0.0012

Activities

Activity type Activity value Assay description Source Reference
SP (functional) = 0 % Evaluated in vitro for percent agonist activity in guinea pig ileum (substance P receptor) ChEMBL. 2433442

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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