Detailed information for compound 448369

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 460.485 | Formula: C17H32N8O7
  • H donors: 9 H acceptors: 7 LogP: -7.4 Rotable bonds: 19
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(N[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(=O)O)CNNC(=O)[C@H](CCCNC(=N)N)N
  • InChi: 1S/C17H32N8O7/c1-8(2)13(16(31)32)24-15(30)10(6-12(27)28)23-11(26)7-22-25-14(29)9(18)4-3-5-21-17(19)20/h8-10,13,22H,3-7,18H2,1-2H3,(H,23,26)(H,24,30)(H,25,29)(H,27,28)(H,31,32)(H4,19,20,21)/t9-,10+,13-/m0/s1
  • InChiKey: MYVBNAKJFNMTQM-CWSCBRNRSA-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
Plasmodium falciparum cysteine repeat modular protein 1 0.0055 0.1094 0.5
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0022 0.0108 0.0083
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0034 0.0469 0.0365
Trypanosoma cruzi hypothetical protein, conserved 0.0055 0.1094 1
Schistosoma mansoni nuclear receptor 0.0166 0.4424 0.4364
Schistosoma mansoni thyroid hormone receptor 0.0351 1 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0186 0.5021 0.5009
Echinococcus multilocularis muscleblind protein 1 0.0127 0.326 0.3243
Brugia malayi Muscleblind-like protein 0.0127 0.326 0.326
Schistosoma mansoni tar DNA-binding protein 0.0047 0.0862 0.0763
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0022 0.0108 0.0083
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0034 0.0461 0.0357
Onchocerca volvulus Protein ultraspiracle homolog 0.0351 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0288 0.8093 0.8093
Schistosoma mansoni nuclear receptor 0.0166 0.4424 0.4364
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0351 1 1
Onchocerca volvulus Arrow homolog 0.0046 0.0822 0.0379
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0351 1 1
Brugia malayi Trypsin family protein 0.0034 0.0461 0.0461
Echinococcus multilocularis laminin 0.0046 0.0822 0.08
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0351 1 1
Schistosoma mansoni voltage-gated potassium channel 0.0096 0.2332 0.2249
Echinococcus granulosus ecdysone induced protein 78C 0.0351 1 1
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0166 0.4424 0.4411
Schistosoma mansoni hypothetical protein 0.0246 0.6849 0.6815
Loa Loa (eye worm) trypsin family protein 0.0034 0.0461 0.0461
Brugia malayi nuclear hormone receptor family member nhr-6 0.0166 0.4424 0.4424
Brugia malayi hypothetical protein 0.0034 0.0461 0.0461
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0034 0.0461 0.0438
Brugia malayi Nuclear hormone receptor-like 1 0.0186 0.5021 0.5021
Brugia malayi conserved hypotetical protein 0.0166 0.4424 0.4424
Echinococcus granulosus Nuclear hormone receptor HR96 0.0166 0.4424 0.4411
Loa Loa (eye worm) hypothetical protein 0.0046 0.0822 0.0822
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Echinococcus granulosus histone acetyltransferase MYST2 0.0046 0.0832 0.081
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Echinococcus multilocularis tyrosine protein kinase Srms 0.002 0.0043 0.0019
Brugia malayi mbt repeat family protein 0.0041 0.0664 0.0664
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0351 1 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0022 0.0108 0.0083
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0186 0.5021 0.5021
Echinococcus multilocularis thyroid hormone receptor alpha 0.0351 1 1
Brugia malayi nuclear hormone receptor 0.0351 1 1
Loa Loa (eye worm) RNA binding protein 0.0047 0.0862 0.0862
Loa Loa (eye worm) nuclear hormone receptor 0.0166 0.4424 0.4424
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0055 0.1094 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0351 1 1
Schistosoma mansoni myelin transcription factor 1 myt1 0.0046 0.0832 0.0732
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0351 1 1
Echinococcus granulosus tar DNA binding protein 0.0047 0.0862 0.084
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0186 0.5021 0.5009
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0351 1 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.002 0.0043 0.0019
Onchocerca volvulus Bile acid receptor homolog 0.0351 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.0295 0.0295
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0022 0.0108 0.0083
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0034 0.0469 0.0365
Brugia malayi tailless protein 0.0166 0.4424 0.4424
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0351 1 1
Schistosoma mansoni zinc finger protein 0.0166 0.4424 0.4364
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0351 1 1
Schistosoma mansoni tar DNA-binding protein 0.0047 0.0862 0.0763
Brugia malayi Calcium binding EGF domain containing protein 0.0046 0.0822 0.0822
Echinococcus multilocularis muscleblind protein 0.0127 0.326 0.3243
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0034 0.0469 0.0445
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Echinococcus multilocularis fibrillin 1 0.0046 0.0822 0.08
Echinococcus granulosus tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Schistosoma mansoni sex comb on midleg homolog 0.0041 0.0664 0.0562
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0351 1 1
Brugia malayi hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi mbt repeat family protein 0.0041 0.0664 0.0664
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0046 0.0832 0.081
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0095 0.0095
Loa Loa (eye worm) mbt repeat family protein 0.0041 0.0664 0.0664
Schistosoma mansoni tar DNA-binding protein 0.0047 0.0862 0.0763
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi Nuclear hormone receptor E75 0.0166 0.4424 0.4424
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0022 0.0108 0.0083
Brugia malayi Nuclear hormone receptor-like 1 0.0186 0.5021 0.5021
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0292 0.8206 0.8187
Onchocerca volvulus 0.0041 0.0664 0.0212
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0166 0.4424 0.4411
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0166 0.4424 0.4155
Echinococcus granulosus tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0041 0.0664 0.0212
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0664 0.0664
Brugia malayi photoreceptor-specific nuclear receptor 0.0351 1 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0166 0.4424 0.4411
Brugia malayi nuclear receptor RXR 0.0166 0.4424 0.4424
Loa Loa (eye worm) SRC-1 0.0022 0.0108 0.0108
Loa Loa (eye worm) hypothetical protein 0.0034 0.0461 0.0461
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0022 0.0108 0.0083
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0046 0.0832 0.081
Loa Loa (eye worm) hypothetical protein 0.0055 0.1094 0.1094
Schistosoma mansoni nuclear hormone receptor 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0127 0.326 0.326
Loa Loa (eye worm) bone morphogenetic protein 1b 0.005 0.0935 0.0935
Loa Loa (eye worm) hypothetical protein 0.005 0.0935 0.0935
Schistosoma mansoni steroid hormone receptor ad4bp 0.0351 1 1
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0034 0.0461 0.0438
Toxoplasma gondii aldehyde dehydrogenase 0.0109 0.2733 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0034 0.0461 0.0357
Echinococcus granulosus glycoprotein Antigen 5 0.0034 0.0461 0.0438
Echinococcus granulosus endonuclease exonuclease phosphatase 0.016 0.4245 0.4231
Echinococcus granulosus tyrosine protein kinase Src42A 0.0022 0.0108 0.0083
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0186 0.5021 0.4967
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Onchocerca volvulus 0.0351 1 1
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0046 0.0832 0.0832
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Brugia malayi RNA recognition motif domain containing protein 0.0047 0.0862 0.0862
Echinococcus multilocularis tyrosine protein kinase Fyn 0.002 0.0043 0.0019
Echinococcus granulosus polycomb protein SCMH1 0.0041 0.0664 0.0641
Loa Loa (eye worm) nuclear receptor NHR-67 0.0166 0.4424 0.4424
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0351 1 1
Schistosoma mansoni nuclear hormone receptor 0.0166 0.4424 0.4364
Brugia malayi Cytochrome P450 family protein 0.0028 0.0295 0.0295
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0038 0.0574 0.0471
Loa Loa (eye worm) hypothetical protein 0.0127 0.326 0.326
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0351 1 1
Loa Loa (eye worm) steroid hormone receptor 0.0351 1 1
Echinococcus granulosus transmembrane protease serine 3 0.0034 0.0461 0.0438
Echinococcus granulosus Mastin 0.0034 0.0461 0.0438
Brugia malayi Voltage-gated potassium channel, Shaker-family (KCNA, Kv1-like) alpha-subunit 0.0096 0.2332 0.2332
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0351 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0351 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Schistosoma mansoni nuclear hormone receptor 0.0166 0.4424 0.4364
Brugia malayi nuclear receptor NHR-67 0.0166 0.4424 0.4424
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0351 1 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0351 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0109 0.2733 1
Echinococcus multilocularis tar DNA binding protein 0.0047 0.0862 0.084
Schistosoma mansoni coup transcription factor 0.0351 1 1
Brugia malayi steroid hormone receptor 0.0351 1 1
Schistosoma mansoni tar DNA-binding protein 0.0047 0.0862 0.0763
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0022 0.0108 0.0083
Loa Loa (eye worm) hypothetical protein 0.0046 0.0822 0.0822
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0034 0.0469 0.0469
Echinococcus multilocularis tyrosine protein kinase Blk 0.002 0.0043 0.0019
Schistosoma mansoni RAR-like nuclear receptor 0.0351 1 1
Brugia malayi Nuclear hormone receptor E75 0.0166 0.4424 0.4424
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0034 0.0469 0.0365
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0351 1 1
Echinococcus granulosus tyrosine kinase 0.002 0.0043 0.0019
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0351 1 1
Brugia malayi Fibulin-1 precursor 0.0046 0.0822 0.0822
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0186 0.5021 0.4967
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Echinococcus granulosus SAM and MBT domain containing protein 0.0041 0.0664 0.0641
Brugia malayi nuclear receptor RXR 0.0186 0.5021 0.5021
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0034 0.0469 0.0445
Schistosoma mansoni hypothetical protein 0.0034 0.0461 0.0357
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0351 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0351 1 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.016 0.4245 0.4231
Brugia malayi hypothetical protein 0.0186 0.5021 0.5021
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0166 0.4424 0.4364
Echinococcus multilocularis Mastin 0.0034 0.0461 0.0438
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0047 0.0862 0.0862
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0034 0.0461 0.0438
Schistosoma mansoni thyroid hormone receptor 0.0351 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0166 0.4424 0.4411
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Mycobacterium ulcerans hypothetical protein 0.0034 0.0461 0.1687
Loa Loa (eye worm) MBCTL1 0.0046 0.0832 0.0832
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0461 0.0461
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0109 0.2733 0.5
Brugia malayi Trypsin-like protease protein 5 0.0034 0.0461 0.0461
Echinococcus granulosus FTZ F1 alpha 0.0351 1 1
Brugia malayi protein-tyrosine kinase 0.002 0.0043 0.0043
Echinococcus granulosus potassium voltage gated channel protein 0.0096 0.2332 0.2314
Echinococcus multilocularis potassium voltage gated channel subfamily A 0.0092 0.2206 0.2187
Onchocerca volvulus 0.0166 0.4424 0.4155
Onchocerca volvulus 0.0254 0.7078 0.6937
Echinococcus granulosus laminin 0.0046 0.0822 0.08
Schistosoma mansoni aldehyde dehydrogenase 0.0109 0.2733 0.2654
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0034 0.0469 0.0445
Brugia malayi hypothetical protein 0.0186 0.5021 0.5021
Loa Loa (eye worm) DR-78 0.0166 0.4424 0.4424
Schistosoma mansoni sex comb on midleg homolog 0.0041 0.0664 0.0562
Echinococcus multilocularis tissue type plasminogen activator 0.0055 0.1094 0.1073
Echinococcus granulosus thyroid hormone receptor alpha 0.0166 0.4424 0.4411
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0351 1 1
Schistosoma mansoni nuclear receptor nhr-48 0.0166 0.4424 0.4364
Loa Loa (eye worm) TAR-binding protein 0.0047 0.0862 0.0862
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0166 0.4424 0.4424
Echinococcus multilocularis FTZ F1 alpha 0.0351 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0109 0.2733 0.2715
Loa Loa (eye worm) hypothetical protein 0.0034 0.0461 0.0461
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0351 1 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0351 1 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0351 1 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0351 1 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0046 0.0832 0.081
Brugia malayi Kringle domain containing protein 0.0055 0.1094 0.1094
Brugia malayi Steroid receptor seven-up type 2 0.0351 1 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0288 0.8093 0.8073
Loa Loa (eye worm) hypothetical protein 0.0186 0.5021 0.5021
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0034 0.0461 0.0461
Echinococcus granulosus muscleblind protein 0.0127 0.326 0.3243
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0046 0.0822 0.0822
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0351 1 1
Brugia malayi nuclear receptor NHR-88 0.0351 1 1
Brugia malayi orphan nuclear receptor NR2E1 0.0166 0.4424 0.4424
Echinococcus multilocularis transmembrane protease serine 3 0.0034 0.0461 0.0438
Brugia malayi RNA binding protein 0.0047 0.0862 0.0862
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0109 0.2733 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0461 0.0461
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0351 1 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0034 0.0461 0.0357
Onchocerca volvulus 0.0288 0.8093 0.8001
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Echinococcus multilocularis glycoprotein Antigen 5 0.0034 0.0461 0.0438
Echinococcus granulosus tyrosine protein kinase Src64B 0.0022 0.0108 0.0083
Echinococcus granulosus potassium voltage gated channel subfamily A 0.0096 0.2332 0.2314
Brugia malayi nuclear hormone receptor 0.0166 0.4424 0.4424
Schistosoma mansoni voltage-gated potassium channel 0.0096 0.2332 0.2249
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0022 0.0108 0.0083
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Schistosoma mansoni egf-like domain protein 0.0046 0.0822 0.0722
Schistosoma mansoni hypothetical protein 0.0055 0.1094 0.0998
Toxoplasma gondii kringle domain-containing protein 0.0055 0.1094 0.1424
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0351 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0034 0.0469 0.0445
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0166 0.4424 0.4424
Schistosoma mansoni tar DNA-binding protein 0.0047 0.0862 0.0763
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Brugia malayi Trypsin family protein 0.0034 0.0461 0.0461
Echinococcus granulosus tyrosine protein kinase Blk 0.002 0.0043 0.0019
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0041 0.0664 0.0562
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0351 1 1
Echinococcus multilocularis enteropeptidase 0.0034 0.0461 0.0438
Brugia malayi SRC-1 0.0022 0.0108 0.0108
Echinococcus granulosus tissue type plasminogen activator 0.0055 0.1094 0.1073
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0022 0.0108 0.0083
Echinococcus granulosus nuclear receptor nhr 48 0.0166 0.4424 0.4411
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Echinococcus multilocularis nuclear receptor nhr 48 0.0166 0.4424 0.4411
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi Trypsin family protein 0.0034 0.0461 0.0461
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0034 0.0461 0.0357
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0046 0.0822 0.0822
Echinococcus multilocularis SAM and MBT domain containing protein 0.0041 0.0664 0.0641
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi ecdysone receptor 0.0166 0.4424 0.4424
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0351 1 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0034 0.0461 0.0357
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Echinococcus granulosus Tolloid protein 1 0.005 0.0935 0.0913
Schistosoma mansoni hypothetical protein 0.0034 0.0461 0.0357
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0166 0.4424 0.4411
Mycobacterium ulcerans aldehyde dehydrogenase 0.0109 0.2733 1
Onchocerca volvulus 0.0166 0.4424 0.4155
Loa Loa (eye worm) hypothetical protein 0.0186 0.5021 0.5021
Echinococcus granulosus Nuclear hormone receptor HR96 0.0166 0.4424 0.4411
Loa Loa (eye worm) TK protein kinase 0.002 0.0043 0.0043
Loa Loa (eye worm) hypothetical protein 0.0034 0.0461 0.0461
Brugia malayi GCC2 and GCC3 family protein 0.0022 0.0095 0.0095
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0351 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Leishmania major hypothetical protein, conserved 0.0055 0.1094 0.4004
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.005 0.0935 0.0836
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0832 0.0832
Loa Loa (eye worm) hypothetical protein 0.0288 0.8093 0.8093
Brugia malayi TAR-binding protein 0.0047 0.0862 0.0862
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0351 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0109 0.2733 1
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0046 0.0822 0.0822
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0351 1 1
Brugia malayi Trypsin family protein 0.0288 0.8093 0.8093
Echinococcus multilocularis Tolloid protein 1 0.005 0.0935 0.0913
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0109 0.2733 0.2715
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0351 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0166 0.4424 0.4411
Loa Loa (eye worm) hypothetical protein 0.0096 0.2332 0.2332
Loa Loa (eye worm) hypothetical protein 0.0059 0.1207 0.1207
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0351 1 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0166 0.4424 0.4411
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0351 1 1
Echinococcus multilocularis potassium voltage gated channel protein 0.0096 0.2332 0.2314
Trypanosoma brucei cytochrome P450, putative 0.0018 0 0.5
Onchocerca volvulus 0.0055 0.1094 0.0664
Schistosoma mansoni aldehyde dehydrogenase 0.0109 0.2733 0.2654
Brugia malayi Protein kinase domain containing protein 0.0056 0.1113 0.1113
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0034 0.0469 0.0469
Loa Loa (eye worm) TK/ROR protein kinase 0.0056 0.1113 0.1113
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0034 0.0461 0.0438
Brugia malayi nuclear receptor NHR-88 0.0166 0.4424 0.4424
Loa Loa (eye worm) hypothetical protein 0.0186 0.5021 0.5021
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0351 1 1
Loa Loa (eye worm) hypothetical protein 0.0186 0.5021 0.5021
Schistosoma mansoni cercarial elastase (S01 family) 0.0034 0.0461 0.0357
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0351 1 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.0022 0.0108 0.0083
Loa Loa (eye worm) hypothetical protein 0.0166 0.4424 0.4424
Brugia malayi nuclear hormone receptor family member odr-7 0.0166 0.4424 0.4424
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0166 0.4424 0.4155
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0351 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0351 1 1
Echinococcus multilocularis polycomb protein SCMH1 0.0041 0.0664 0.0641
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0166 0.4424 0.4364
Loa Loa (eye worm) hypothetical protein 0.0046 0.0822 0.0822
Loa Loa (eye worm) hypothetical protein 0.0186 0.5021 0.5021
Echinococcus granulosus enteropeptidase 0.0034 0.0461 0.0438

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 7.05 mg Antithrombotic effect in Wistar rat assessed as reduction in dry thrombus mass at 5 umol/L ChEMBL. 17827017
Activity (functional) = 34.98 mg Antithrombotic effect in Wistar rat assessed as reduction in wet thrombus mass at 5 umol/L ChEMBL. 17827017
Inhibition (functional) = 12.09 % Inhibition of ADP-induced platelet aggregation in rabbit platelet rich plasma at 0.1 umol/L ChEMBL. 17827017
Inhibition (functional) = 20.54 % Inhibition of PAF-induced platelet aggregation in rabbit platelet rich plasma at 0.1 umol/L ChEMBL. 17827017
Inhibition (functional) = 28.2 % Inhibition of ADP-induced platelet aggregation in rabbit platelet rich plasma at 1 umol/L ChEMBL. 17827017
Inhibition (functional) = 36.43 % Inhibition of PAF-induced platelet aggregation in rabbit platelet rich plasma at 1 umol/L ChEMBL. 17827017
Inhibition (functional) = 45 % Inhibition of ADP-induced platelet aggregation in rabbit platelet rich plasma at 10 umol/L ChEMBL. 17827017
Inhibition (functional) = 54.93 % Inhibition of PAF-induced platelet aggregation in rabbit platelet rich plasma at 10 umol/L ChEMBL. 17827017

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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