Detailed information for compound 285572

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 361.248 | Formula: C11H16N5O7P
  • H donors: 4 H acceptors: 7 LogP: -3.02 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC1C(O)C(OC1n1cnc2c1ncnc2N)COP(=O)(O)O
  • InChi: 1S/C11H16N5O7P/c1-21-8-7(17)5(2-22-24(18,19)20)23-11(8)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17H,2H2,1H3,(H2,12,13,14)(H2,18,19,20)
  • InChiKey: TVGFEBXIZUYVFR-UHFFFAOYSA-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 calpain 0.0019 0.0393 0.0375
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0144 0.4413 0.8965
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Schistosoma mansoni calpain-7 (C02 family) 0.0019 0.0393 0.0375
Brugia malayi hypothetical protein 0.0068 0.1975 0.3932
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0288 0.0269
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0068 0.1975 0.1959
Schistosoma mansoni cpg binding protein 0.0028 0.069 0.0672
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0144 0.4413 0.4402
Brugia malayi conserved hypotetical protein 0.0068 0.1975 0.3932
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0068 0.1975 0.3932
Schistosoma mansoni retinoic acid receptor RXR 0.0144 0.4413 0.4402
Brugia malayi nuclear receptor NHR-88 0.0144 0.4413 0.8966
Plasmodium vivax calpain, putative 0.0019 0.0393 0.5
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0076 0.2236 0.2221
Schistosoma mansoni P2X receptor subunit 0.0317 1 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0144 0.4413 0.4402
Echinococcus multilocularis calpain 7 (C02 family) 0.0019 0.0393 0.0375
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0144 0.4413 0.4402
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0144 0.4413 0.4402
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0068 0.1975 0.3042
Loa Loa (eye worm) hypothetical protein 0.0044 0.1204 0.2334
Brugia malayi photoreceptor-specific nuclear receptor 0.0144 0.4413 0.8966
Brugia malayi calpain 5 0.0019 0.0393 0.0667
Echinococcus granulosus FTZ F1 alpha 0.0144 0.4413 0.4402
Schistosoma mansoni nuclear receptor nhr-48 0.0068 0.1975 0.1959
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0068 0.1975 0.1959
Trypanosoma brucei kinesin, putative 0.0019 0.0393 0.5
Brugia malayi ecdysone receptor 0.0068 0.1975 0.3932
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0068 0.1975 0.1959
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0076 0.2236 0.4467
Echinococcus granulosus thyroid hormone receptor alpha 0.0068 0.1975 0.1959
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0288 0.0449
Brugia malayi nuclear receptor NHR-88 0.0068 0.1975 0.3932
Brugia malayi nuclear hormone receptor 0.0144 0.4413 0.8966
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0144 0.4413 0.8965
Echinococcus granulosus tar DNA binding protein 0.0061 0.1766 0.175
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0144 0.4413 0.4402
Trypanosoma brucei calpain-like protein, putative 0.0019 0.0393 0.5
Schistosoma mansoni Mername-AA248 (C02 family) 0.0019 0.0393 0.0375
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0144 0.4413 0.8965
Brugia malayi nuclear receptor RXR 0.0076 0.2236 0.4471
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0144 0.4413 0.4402
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0144 0.4413 0.8966
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0159 0.4914 1
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Trypanosoma brucei calpain-like protein, putative 0.0019 0.0393 0.5
Onchocerca volvulus 0.0159 0.4914 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.2236 0.4467
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0068 0.1975 0.1959
Onchocerca volvulus 0.0068 0.1975 0.3042
Onchocerca volvulus 0.0044 0.1204 0.1216
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0068 0.1975 0.1959
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.1347 0.2635
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Schistosoma mansoni coup transcription factor 0.0144 0.4413 0.4402
Schistosoma mansoni P2X receptor subunit 0.0157 0.4857 0.4847
Echinococcus granulosus calpain A 0.0065 0.1902 0.1886
Schistosoma mansoni cpg binding protein 0.0029 0.0741 0.0723
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0144 0.4413 0.8966
Schistosoma mansoni P2X receptor subunit 0.0317 1 1
Echinococcus multilocularis hypothetical protein 0.0019 0.0393 0.0375
Brugia malayi nuclear hormone receptor family member odr-7 0.0068 0.1975 0.3932
Brugia malayi tailless protein 0.0068 0.1975 0.3932
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Onchocerca volvulus Bile acid receptor homolog 0.0144 0.4413 0.8814
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0 0.5
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1766 0.175
Brugia malayi Nuclear hormone receptor-like 1 0.0144 0.4413 0.8966
Brugia malayi Steroid receptor seven-up type 2 0.0144 0.4413 0.8966
Entamoeba histolytica protein kinase, putative 0.0019 0.0393 0.5
Echinococcus granulosus family C2 unassigned peptidase C02 family 0.0065 0.1902 0.1886
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0144 0.4413 0.8965
Onchocerca volvulus 0.0144 0.4413 0.8814
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Schistosoma mansoni calpain-7 (C02 family) 0.0019 0.0393 0.0375
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Echinococcus granulosus cpg binding protein 0.0029 0.0741 0.0723
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0076 0.2236 0.2221
Schistosoma mansoni hypothetical protein 0.0015 0.0288 0.0269
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Schistosoma mansoni calpain (C02 family) 0.0019 0.0393 0.0375
Loa Loa (eye worm) DR-78 0.0068 0.1975 0.3928
Echinococcus multilocularis tar DNA binding protein 0.0061 0.1766 0.175
Trichomonas vaginalis helicase, putative 0.0006 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0288 0.0269
Schistosoma mansoni thyroid hormone receptor 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0033 0.0857 0.1617
Loa Loa (eye worm) hypothetical protein 0.0044 0.1204 0.2334
Echinococcus multilocularis calpain 0.0019 0.0393 0.0375
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0144 0.4413 0.4402
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.1691 0.1674
Echinococcus multilocularis family C2 unassigned peptidase (C02 family) 0.0065 0.1902 0.1886
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0144 0.4413 0.8966
Brugia malayi nuclear receptor RXR 0.0068 0.1975 0.3932
Trypanosoma cruzi kinesin, putative 0.0019 0.0393 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0144 0.4413 0.4402
Brugia malayi nuclear receptor NHR-67 0.0068 0.1975 0.3932
Entamoeba histolytica calpain large subunit domain III containing protein 0.0019 0.0393 0.5
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Brugia malayi Nuclear hormone receptor-like 1 0.0076 0.2236 0.4471
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0144 0.4413 0.8965
Echinococcus multilocularis cpg binding protein 0.0029 0.0741 0.0723
Schistosoma mansoni nuclear hormone receptor 0.0068 0.1975 0.1959
Echinococcus granulosus Nuclear hormone receptor HR96 0.0068 0.1975 0.1959
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0144 0.4413 0.8814
Trypanosoma cruzi calpain cysteine peptidase, putative 0.0019 0.0393 0.5
Schistosoma mansoni zinc finger protein 0.0068 0.1975 0.1959
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0068 0.1975 0.1959
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0144 0.4413 0.8965
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0062 0.1799 0.1783
Brugia malayi nuclear hormone receptor family member nhr-6 0.0068 0.1975 0.3932
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0144 0.4413 0.4402
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0074 0.0055
Trypanosoma cruzi kinesin, putative 0.0019 0.0393 0.5
Brugia malayi ecdysteroid receptor 0.0144 0.4413 0.8966
Leishmania major kinesin, putative 0.0019 0.0393 0.5
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0065 0.1902 0.1886
Echinococcus multilocularis ecdysone induced protein 78C 0.0144 0.4413 0.4402
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0288 0.0449
Loa Loa (eye worm) hypothetical protein 0.0048 0.1347 0.263
Brugia malayi hypothetical protein 0.0159 0.4914 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0144 0.4413 0.8965
Onchocerca volvulus Protein ultraspiracle homolog 0.0144 0.4413 0.8814
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Echinococcus granulosus p2X purinoceptor 4 0.0317 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0144 0.4413 0.8966
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0144 0.4413 0.8966
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0068 0.1975 0.1959
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0144 0.4413 0.4402
Loa Loa (eye worm) calpain family protein 1 0.0062 0.1799 0.3565
Echinococcus multilocularis calpain 5 0.0019 0.0393 0.0375
Echinococcus granulosus nuclear receptor nhr 48 0.0068 0.1975 0.1959
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.1488 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0144 0.4413 0.8966
Brugia malayi nuclear hormone receptor 0.0068 0.1975 0.3932
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Brugia malayi calpain 7 0.0019 0.0393 0.0667
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0076 0.2236 0.4467
Echinococcus granulosus calpain A 0.0019 0.0393 0.0375
Brugia malayi calpain family protein 1 0.0062 0.1799 0.357
Schistosoma mansoni nuclear receptor 0.0068 0.1975 0.1959
Loa Loa (eye worm) steroid hormone receptor 0.0144 0.4413 0.8965
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0061 0.1766 0.3496
Echinococcus multilocularis FTZ F1 alpha 0.0144 0.4413 0.4402
Loa Loa (eye worm) TAR-binding protein 0.0061 0.1766 0.3496
Loa Loa (eye worm) hypothetical protein 0.0062 0.1799 0.3565
Schistosoma mansoni hypothetical protein 0.0015 0.0288 0.0269
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0076 0.2236 0.2221
Leishmania major calpain, putative,cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0144 0.4413 0.4402
Schistosoma mansoni nuclear receptor 0.0068 0.1975 0.1959
Echinococcus multilocularis GPCR, family 2 0.0015 0.0288 0.0269
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0144 0.4413 0.4402
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0288 0.0269
Brugia malayi CXXC zinc finger family protein 0.0028 0.069 0.128
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0068 0.1975 0.3042
Brugia malayi Nuclear hormone receptor E75 0.0068 0.1975 0.3932
Loa Loa (eye worm) hypothetical protein 0.0076 0.2236 0.4467
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0006 0 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0076 0.2236 0.4471
Echinococcus multilocularis thyroid hormone receptor alpha 0.0144 0.4413 0.4402
Schistosoma mansoni thyroid hormone receptor 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0076 0.2236 0.4467
Schistosoma mansoni hypothetical protein 0.0015 0.0288 0.0269
Echinococcus granulosus p2X purinoceptor 4 0.0317 1 1
Trypanosoma brucei calpain-like protein, putative 0.0019 0.0393 0.5
Loa Loa (eye worm) hypothetical protein 0.0076 0.2236 0.4467
Loa Loa (eye worm) calpain 5 0.0019 0.0393 0.066
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Schistosoma mansoni RAR-like nuclear receptor 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Echinococcus granulosus GPCR family 2 0.0015 0.0288 0.0269
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0144 0.4413 0.8966
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Loa Loa (eye worm) nuclear hormone receptor 0.0068 0.1975 0.3928
Echinococcus granulosus ecdysone induced protein 78C 0.0144 0.4413 0.4402
Schistosoma mansoni nuclear hormone receptor 0.0144 0.4413 0.4402
Echinococcus granulosus calpain 5 0.0019 0.0393 0.0375
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Trypanosoma brucei calpain-like protein, putative 0.0019 0.0393 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0144 0.4413 0.8966
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0006 0 0.5
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0144 0.4413 0.4402
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0144 0.4413 0.8966
Loa Loa (eye worm) hypothetical protein 0.0062 0.1799 0.3565
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1766 0.175
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1766 0.175
Echinococcus multilocularis calpain family protein 1, d 0.0044 0.1204 0.1187
Brugia malayi RNA binding protein 0.0061 0.1766 0.3501
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Loa Loa (eye worm) RNA binding protein 0.0061 0.1766 0.3496
Brugia malayi Nuclear hormone receptor E75 0.0068 0.1975 0.3932
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1766 0.175
Echinococcus multilocularis p2X purinoceptor 4 0.0317 1 1
Brugia malayi hypothetical protein 0.0076 0.2236 0.4471
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0144 0.4413 0.8966
Schistosoma mansoni cpg binding protein 0.0029 0.0741 0.0723
Echinococcus multilocularis calpain A 0.0065 0.1902 0.1886
Schistosoma mansoni P2X receptor subunit 0.0157 0.4857 0.4847
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0144 0.4413 0.8966
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0065 0.1902 0.1886
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Echinococcus multilocularis nuclear receptor nhr 48 0.0068 0.1975 0.1959
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0857 0.1623
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0144 0.4413 0.8966
Echinococcus multilocularis p2X purinoceptor 4 0.0317 1 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.069 0.1273
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Brugia malayi steroid hormone receptor 0.0144 0.4413 0.8966
Loa Loa (eye worm) calpain family protein 1 0.0044 0.1204 0.2334
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0076 0.2236 0.2221
Brugia malayi orphan nuclear receptor NR2E1 0.0068 0.1975 0.3932
Brugia malayi hypothetical protein 0.0076 0.2236 0.4471
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0074 0.0055
Brugia malayi calpain family protein 1 0.0062 0.1799 0.357
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0068 0.1975 0.1959
Schistosoma mansoni hypothetical protein 0.0033 0.0857 0.0839
Loa Loa (eye worm) hypothetical protein 0.0144 0.4413 0.8965
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Loa Loa (eye worm) nuclear receptor NHR-67 0.0068 0.1975 0.3928
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0144 0.4413 0.4402
Brugia malayi hypothetical protein 0.0068 0.1975 0.3932
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.0019 0.0393 0.5
Echinococcus granulosus calpain 7 C02 family 0.0019 0.0393 0.0375
Schistosoma mansoni nuclear hormone receptor 0.0068 0.1975 0.1959
Schistosoma mansoni hypothetical protein 0.0015 0.0288 0.0269
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.1347 0.2635
Echinococcus granulosus Nuclear hormone receptor HR96 0.0068 0.1975 0.1959
Onchocerca volvulus 0.0068 0.1975 0.3042
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0144 0.4413 0.4402
Trypanosoma brucei antigen, putative 0.0019 0.0393 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0288 0.0442
Echinococcus multilocularis p2X purinoceptor 4 0.0317 1 1
Schistosoma mansoni calpain C (C02 family) 0.0019 0.0393 0.0375
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Loa Loa (eye worm) calpain 0.0019 0.0393 0.066
Brugia malayi RNA recognition motif domain containing protein 0.0061 0.1766 0.3501
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.1347 0.263
Loa Loa (eye worm) hypothetical protein 0.0015 0.0288 0.0442
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0144 0.4413 0.4402
Trichomonas vaginalis conserved hypothetical protein 0.0006 0 0.5
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.0019 0.0393 0.5
Brugia malayi TAR-binding protein 0.0061 0.1766 0.3501
Schistosoma mansoni steroid hormone receptor ad4bp 0.0144 0.4413 0.4402
Loa Loa (eye worm) hypothetical protein 0.0068 0.1975 0.3928
Schistosoma mansoni tar DNA-binding protein 0.0061 0.1766 0.175
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0068 0.1975 0.3928
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0288 0.0269
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0144 0.4413 0.4402
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0144 0.4413 0.8966
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0068 0.1975 0.1959

Activities

Activity type Activity value Assay description Source Reference
Inhibition index (functional) = 0.017 Inhibition index was the ratio between KM of AMP and Ki of AK III ChEMBL. 6286970
Inhibition index (functional) = 0.022 Inhibition index was the ratio between KM of AMP and Ki of AK II ChEMBL. 6286970
Inhibition index (functional) = 0.14 Inhibition index was the ratio between KM of AMP and Ki of AK M ChEMBL. 6286970
Ki (binding) = 3.6 mM Competitive inhibitory constant with Rat adenylate kinase II isozyme ChEMBL. 6286970
Ki (binding) = 4.1 mM Competitive inhibitory constant with Rat adenylate kinase M isozyme ChEMBL. 6286970
Ki (binding) = 4.8 mM Competitive inhibitory constant with Rat adenylate kinase III ChEMBL. 6286970
Relative inhibition index (functional) = 6.4 Relative inhibition index was the ratio between AK-M and AK II ChEMBL. 6286970
Relative inhibition index (functional) = 8.2 Relative inhibition index was the ratio between AK-M and AK III ChEMBL. 6286970
Relative Vmax (binding) > 0 Relative Vmax value to rat adenylate kinase II. ChEMBL. 6286970
Relative Vmax (binding) > 0 Relative Vmax value to rat adenylate kinase III. ChEMBL. 6286970
Relative Vmax (binding) > 0 Relative Vmax value to Adenylate kinase M isoenzyme (adenylate kinase 1, AK1) ChEMBL. 6286970

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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