Detailed information for compound 1767468

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 226.312 | Formula: C13H22O3
  • H donors: 1 H acceptors: 2 LogP: 2.08 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC[C@@H](C1=C(OC)[C@@H]([C@](C1=O)(C)CC)O)C
  • InChi: 1S/C13H22O3/c1-6-8(3)9-10(16-5)12(15)13(4,7-2)11(9)14/h8,12,15H,6-7H2,1-5H3/t8-,12-,13+/m0/s1
  • InChiKey: UOZDDNRMIPAGFH-AQUOVQTQSA-N  


Substructure search Similarity search

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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
Loa Loa (eye worm) hypothetical protein 0.002 0.0019 0.061
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Plasmodium vivax vivapain-2 0.0052 0.0078 0.5757
Entamoeba histolytica hypothetical protein 0.0035 0.0046 0.3354
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Loa Loa (eye worm) multidrug resistance protein 3 0.002 0.0019 0.061
Plasmodium vivax unspecified product 0.0017 0.0013 0.0013
Schistosoma mansoni cysteinyl-tRNA synthetase 0.0077 0.0126 0.4033
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0006 0.0139
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.0034 0.1096
Echinococcus multilocularis follistatin 0.0092 0.0155 0.4955
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Echinococcus multilocularis cysteine protease 0.0052 0.0078 0.2491
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.0176 0.0314 1
Echinococcus granulosus multidrug resistance protein 1 0.002 0.0019 0.061
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) hypothetical protein 0.0018 0.0014 0.0441
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Trypanosoma cruzi cysteine peptidase, putative 0.0197 0.0353 1
Onchocerca volvulus 0.0052 0.0078 0.2003
Loa Loa (eye worm) hypothetical protein 0.0017 0.0013 0.0404
Brugia malayi Papain family cysteine protease containing protein 0.0027 0.0031 0.098
Loa Loa (eye worm) hypothetical protein 0.0126 0.022 0.701
Entamoeba histolytica cysteine protease, putative 0.0052 0.0078 0.5994
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Onchocerca volvulus 0.0092 0.0155 0.4627
Brugia malayi Cytochrome P450 family protein 0.0029 0.0034 0.1096
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Onchocerca volvulus Putative organic anion transporter 0.0176 0.0314 1
Brugia malayi cysteinyl tRNA synthetase protein 1 0.0077 0.0126 0.4033
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Echinococcus granulosus Solute carrier organic anion transporter family 0.0176 0.0314 1
Entamoeba histolytica cysteine proteinase, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0052 0.0078 0.2491
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.002 0.0019 0.0597
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Brugia malayi Cytochrome P450 family protein 0.0031 0.0039 0.1234
Entamoeba histolytica hypothetical protein 0.0035 0.0046 0.3354
Trichomonas vaginalis abcb9, putative 0.002 0.0019 0.1107
Echinococcus granulosus RUN 0.0021 0.0019 0.062
Echinococcus multilocularis multidrug resistance protein 1 0.002 0.0019 0.061
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.002 0.0019 0.061
Echinococcus granulosus multidrug resistance protein 1 0.002 0.0019 0.061
Onchocerca volvulus Cathepsin F homolog 0.0052 0.0078 0.2003
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus multilocularis cysteine protease 0.0052 0.0078 0.2491
Onchocerca volvulus Cathepsin L homolog 0.0052 0.0078 0.2003
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0071 0.2264
Leishmania major cathepsin L-like protease 0.0197 0.0353 1
Loa Loa (eye worm) doublecortin family protein 0.0021 0.0019 0.062
Echinococcus multilocularis Polycystic kidney disease protein 0.0021 0.0019 0.062
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Loa Loa (eye worm) hypothetical protein 0.002 0.0019 0.061
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0027 0.0031 0.098
Brugia malayi cytochrome P450 0.0011 0.0001 0.0029
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0029 0.0034 0.0033
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Brugia malayi Doublecortin family protein 0.0021 0.0019 0.062
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Schistosoma mansoni loxhd1 0.0021 0.0019 0.062
Onchocerca volvulus Putative organic anion transporter 0.0176 0.0314 1
Leishmania major cytochrome p450-like protein 0.0029 0.0034 0.0951
Echinococcus granulosus cathepsin L 0.0027 0.0031 0.098
Onchocerca volvulus 0.0077 0.0126 0.3645
Brugia malayi Papain family cysteine protease containing protein 0.0052 0.0078 0.2491
Entamoeba histolytica P-glycoprotein-2, putative 0.002 0.0019 0.1107
Trichomonas vaginalis DNA helicase recq1, putative 0.0025 0.0028 0.1836
Mycobacterium ulcerans cysteinyl-tRNA synthetase 0.0077 0.0126 0.0126
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.002 0.0019 0.0518
Mycobacterium ulcerans cysteinyl-tRNA synthetase 0.529 1 1
Echinococcus multilocularis agrin 0.0092 0.0155 0.4955
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0071 0.2264
Echinococcus multilocularis RUN 0.0021 0.0019 0.062
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.002 0.0019 0.061
Brugia malayi Cathepsin L-like precursor 0.0017 0.0013 0.0404
Trypanosoma cruzi cysteinyl-tRNA synthetase, putative 0.0077 0.0126 0.3568
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0014 0.0007 0.0137
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0019 0.062
Toxoplasma gondii transporter, major facilitator family protein 0.0176 0.0314 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Schistosoma mansoni cathepsin F (C01 family) 0.0035 0.0046 0.1461
Schistosoma mansoni multidrug resistance protein 0.002 0.0019 0.061
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0092 0.0155 0.4955
Echinococcus granulosus cathepsin l cysteine peptidase 0.0052 0.0078 0.2491
Loa Loa (eye worm) ctsf protein 0.0052 0.0078 0.2491
Onchocerca volvulus 0.0052 0.0078 0.2003
Schistosoma mansoni cathepsin s 0.0017 0.0013 0.0404
Echinococcus granulosus agrin 0.0092 0.0155 0.4955
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0017 0.0013 0.0404
Onchocerca volvulus 0.0052 0.0078 0.2003
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.001 0.000000000008944 0.00000000028518
Entamoeba histolytica cysteine proteinase 2 0.0027 0.0031 0.2067
Brugia malayi Cytochrome P450 family protein 0.0029 0.0034 0.1096
Toxoplasma gondii protease inhibitor PI2 0.0092 0.0155 0.4955
Trichomonas vaginalis abcb9, putative 0.002 0.0019 0.1107
Entamoeba histolytica hypothetical protein 0.0035 0.0046 0.3354
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.002 0.0019 0.1107
Echinococcus multilocularis cathepsin L cysteine protease 0.0052 0.0078 0.2491
Leishmania major p-glycoprotein 0.002 0.0019 0.0518
Plasmodium falciparum cysteine proteinase falcipain 3 0.0052 0.0078 0.6177
Echinococcus multilocularis Solute carrier organic anion transporter family 0.0176 0.0314 1
Onchocerca volvulus Cathepsin L homolog 0.0052 0.0078 0.2003
Brugia malayi hypothetical protein 0.0021 0.0019 0.062
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.002 0.0019 0.061
Echinococcus granulosus cathepsin L cysteine proteinase 0.0052 0.0078 0.2491
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0006 0.0139
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Leishmania major cathepsin L-like protease 0.0052 0.0078 0.2194
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0019 0.062
Onchocerca volvulus 0.0176 0.0314 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0027 0.0031 0.098
Entamoeba histolytica cysteine proteinase, putative 0.0027 0.0031 0.2067
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0071 0.2264
Loa Loa (eye worm) hypothetical protein 0.0092 0.0155 0.4955
Loa Loa (eye worm) hypothetical protein 0.0017 0.0013 0.0404
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0071 0.2264
Loa Loa (eye worm) CYP4Cod1 0.0029 0.0034 0.1096
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0058 0.009 0.2862
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0071 0.2264
Schistosoma mansoni rab6-interacting 0.0021 0.0019 0.062
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Entamoeba histolytica P-glycoprotein-1 0.002 0.0019 0.1107
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0017 0.0013 0.0404
Entamoeba histolytica cysteine proteinase, putative 0.0052 0.0078 0.5994
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0052 0.0078 0.6177
Entamoeba histolytica cysteine proteinase, putative 0.0027 0.0031 0.2067
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0019 0.062
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0022 0.0022 0.1752
Echinococcus multilocularis multidrug resistance protein 1 0.002 0.0019 0.061
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0027 0.0031 0.2067
Loa Loa (eye worm) hypothetical protein 0.0077 0.0126 0.4033
Schistosoma mansoni cytochrome P450 0.0011 0.0001 0.0029
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Brugia malayi sodium-independent organic anion transporter family protein 0.0176 0.0314 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Plasmodium vivax cysteine--tRNA ligase, putative 0.0077 0.0126 1
Plasmodium vivax vivapain-2 0.0052 0.0078 0.5757
Trypanosoma cruzi cysteine proteinase, putative 0.0027 0.0031 0.0847
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0092 0.0155 0.4955
Plasmodium falciparum LCCL domain-containing protein 0.0021 0.0019 0.1537
Loa Loa (eye worm) hypothetical protein 0.0035 0.0046 0.1461
Wolbachia endosymbiont of Brugia malayi cysteinyl-tRNA synthetase 0.0077 0.0126 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0071 0.2264
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Trypanosoma cruzi cytochrome P450, putative 0.0029 0.0034 0.0951
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0027 0.0031 0.0847
Loa Loa (eye worm) hypothetical protein 0.0092 0.0155 0.4955
Onchocerca volvulus Putative organic anion transporter 0.0176 0.0314 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Entamoeba histolytica P-glycoprotein 5, putative 0.002 0.0019 0.1107
Echinococcus multilocularis cathepsin L 0.0027 0.0031 0.098
Brugia malayi sodium-independent organic anion transporter family protein 0.0176 0.0314 1
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.002 0.0019 0.1107
Leishmania major cathepsin L-like protease 0.0052 0.0078 0.2194
Loa Loa (eye worm) hypothetical protein 0.0021 0.0019 0.062
Trichomonas vaginalis DNA helicase recq, putative 0.0025 0.0028 0.1836
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.002 0.0019 0.1107
Trichomonas vaginalis abcb9, putative 0.002 0.0019 0.1107
Plasmodium falciparum multidrug resistance protein 1 0.002 0.0019 0.1513
Brugia malayi secreted modular calcium-binding protein 1 0.0092 0.0155 0.4955
Onchocerca volvulus 0.0176 0.0314 1
Echinococcus granulosus cytochrome P450 2K1 0.0011 0.0001 0.0029
Echinococcus multilocularis cathepsin L cysteine protease 0.0052 0.0078 0.2491
Echinococcus granulosus cysteinyl tRNA synthetase 0.0077 0.0126 0.4033
Entamoeba histolytica cysteinyl-tRNA synthetase, putative 0.0077 0.0126 1
Leishmania major cathepsin L-like protease 0.0052 0.0078 0.2194
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Trypanosoma brucei cysteinyl-tRNA synthetase, putative 0.0077 0.0126 0.3568
Mycobacterium tuberculosis Probable transmembrane multidrug efflux pump 0.002 0.0019 0.0018
Loa Loa (eye worm) cysteinyl tRNA synthetase 1 0.0077 0.0126 0.4033
Schistosoma mansoni cathepsin F (C01 family) 0.0052 0.0078 0.2491
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0035 0.0046 0.3317
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.002 0.0019 0.061
Trichomonas vaginalis ABC transporter, putative 0.002 0.0019 0.1107
Echinococcus granulosus bloom syndrome protein 0.0025 0.0028 0.0891
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0052 0.0078 0.5994
Schistosoma mansoni rab6-interacting 0.0021 0.0019 0.062
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0052 0.0078 0.6177
Mycobacterium tuberculosis Cysteine:1D-myo-inosityl 2-amino-2-deoxy--D-glucopyranoside ligase MshC 0.529 1 1
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Plasmodium falciparum cysteine--tRNA ligase 0.0077 0.0126 1
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.002 0.0019 0.061
Treponema pallidum cysteinyl-tRNA synthetase 0.0077 0.0126 0.5
Schistosoma mansoni hypothetical protein 0.0011 0.0001 0.0029
Loa Loa (eye worm) hypothetical protein 0.0092 0.0155 0.4955
Echinococcus granulosus follistatin 0.0092 0.0155 0.4955
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Echinococcus granulosus cathepsin L cysteine protease 0.0027 0.0031 0.098
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0092 0.0155 0.4955
Trichomonas vaginalis ABC transporter, putative 0.002 0.0019 0.1107
Leishmania major cathepsin L-like protease 0.0052 0.0078 0.2194
Entamoeba histolytica P-glycoprotein-2 0.002 0.0019 0.1107
Schistosoma mansoni cysteinyl-tRNA synthetase 0.0077 0.0126 0.4033
Echinococcus granulosus cathepsin l1 0.0052 0.0078 0.2491
Entamoeba histolytica P-glyco protein 6, putative 0.002 0.0019 0.1107
Brugia malayi hypothetical protein 0.0035 0.0046 0.1475
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0052 0.0078 0.2491
Trypanosoma cruzi cysteine peptidase, putative 0.0197 0.0353 1
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0058 0.009 0.2862
Toxoplasma gondii cathepsin CPL 0.0052 0.0078 0.2491
Entamoeba histolytica cysteine proteinase 1, putative 0.0027 0.0031 0.2067
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.002 0.0019 0.061
Trypanosoma cruzi MFS transporter, putative 0.0176 0.0314 0.8885
Plasmodium vivax multidrug resistance protein 1, putative 0.002 0.0019 0.058
Schistosoma mansoni polycystin 1-related 0.0021 0.0019 0.062
Loa Loa (eye worm) hypothetical protein 0.002 0.0019 0.0597
Trichomonas vaginalis ABC transporter, putative 0.002 0.0019 0.1107
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Plasmodium vivax vivapain-3 0.0027 0.0031 0.1597
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0052 0.0078 0.2491
Trypanosoma cruzi cysteinyl-tRNA synthetase, putative 0.0077 0.0126 0.3568
Trypanosoma cruzi cruzipain precursor, putative 0.0197 0.0353 1
Entamoeba histolytica P-glycoprotein-5 0.002 0.0019 0.1107
Loa Loa (eye worm) kazal-type serine protease inhibitor domain-containing protein 0.0092 0.0155 0.4955
Brugia malayi hypothetical protein 0.0176 0.0314 1
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0092 0.0155 0.4955
Schistosoma mansoni organic anion transporter 0.0176 0.0314 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0027 0.0031 0.0847
Plasmodium vivax multidomain scavenger receptor, putative 0.0021 0.0019 0.0606
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.0034 0.1096
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Brugia malayi multidrug resistance protein 3 0.002 0.0019 0.061
Brugia malayi sodium-independent organic anion transporter family protein 0.0176 0.0314 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0046 0.1475
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Onchocerca volvulus 0.0052 0.0078 0.2003
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0071 0.2264
Plasmodium vivax vivapain-1 0.0027 0.0031 0.1597
Toxoplasma gondii cysteine-tRNA synthetase (CysRS) 0.0077 0.0126 0.4033
Schistosoma mansoni lipoxygenase 0.0021 0.0019 0.062
Echinococcus multilocularis cysteinyl tRNA synthetase 0.0077 0.0126 0.4033
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Echinococcus multilocularis bloom syndrome protein 0.0025 0.0028 0.0891
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0092 0.0155 0.4955
Schistosoma mansoni smdr2 0.002 0.0019 0.061
Trypanosoma cruzi major cysteine proteinase, putative 0.0155 0.0273 0.7735
Echinococcus granulosus multidrug resistance protein 1 0.002 0.0019 0.061
Brugia malayi Cytochrome P450 family protein 0.0011 0.0001 0.0029
Trichomonas vaginalis ABC transporter, half transporter, putative 0.002 0.0019 0.1107
Echinococcus granulosus multidrug resistance protein 1 0.0014 0.0007 0.0237
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Schistosoma mansoni hypothetical protein 0.0035 0.0046 0.1475
Schistosoma mansoni lipoxygenase 0.0058 0.009 0.2862
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus multilocularis ATP binding cassette sub family B 0.002 0.0019 0.0597
Trypanosoma cruzi cysteine peptidase, putative 0.0027 0.0031 0.0847
Leishmania major cathepsin L-like protease 0.0197 0.0353 1
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Trypanosoma cruzi cysteine protease, putative 0.0027 0.0031 0.0847
Entamoeba histolytica cysteine proteinase, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) hypothetical protein 0.0035 0.0046 0.1461
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0052 0.0078 0.2491
Loa Loa (eye worm) hypothetical protein 0.0035 0.0046 0.1461
Onchocerca volvulus 0.0052 0.0078 0.2003
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0035 0.0046 0.3317
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Loa Loa (eye worm) hypothetical protein 0.0092 0.0155 0.4955
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0092 0.0155 0.4955
Onchocerca volvulus 0.0176 0.0314 1
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.002 0.0019 0.061
Trypanosoma cruzi cysteine peptidase, putative 0.0052 0.0078 0.2194
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0046 0.1475
Schistosoma mansoni blooms syndrome DNA helicase 0.002 0.0018 0.0572
Brugia malayi Bloom's syndrome protein homolog 0.0025 0.0028 0.0891
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Brugia malayi prostaglandin transporter 0.0176 0.0314 1
Schistosoma mansoni multidrug resistance protein 0.002 0.0019 0.061
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus granulosus organic anion transporting polypeptide 30B 0.0176 0.0314 1
Onchocerca volvulus 0.0176 0.0314 1
Entamoeba histolytica hypothetical protein 0.0035 0.0046 0.3354
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0019 0.062
Echinococcus granulosus leucyl tRNA synthetase 0.0077 0.0126 0.4033
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0017 0.0012 0.0387
Brugia malayi cathepsin F-like cysteine proteinase 0.0017 0.0013 0.0404
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Loa Loa (eye worm) cysteine protease 0.0052 0.0078 0.2491
Entamoeba histolytica cysteine proteinase, putative 0.0035 0.0046 0.3317
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0092 0.0155 0.4955
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Onchocerca volvulus 0.0176 0.0314 1
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.002 0.0019 0.061
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0027 0.0031 0.098
Plasmodium vivax unspecified product 0.0027 0.0031 0.1597
Schistosoma mansoni follistatin 0.0092 0.0155 0.4955
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Entamoeba histolytica P-glycoprotein-2 0.002 0.0019 0.1107
Echinococcus granulosus cysteine protease 0.0027 0.0031 0.098
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Loa Loa (eye worm) hypothetical protein 0.0052 0.0078 0.2491
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.002 0.0019 0.1107
Brugia malayi Cathepsin L-like cysteine proteinase 0.0035 0.0046 0.1461
Brugia malayi hypothetical protein 0.0176 0.0314 1
Leishmania major cysteinyl-tRNA synthetase, putative 0.0077 0.0126 0.3568
Brugia malayi hypothetical protein 0.0021 0.0019 0.062
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0027 0.0031 0.0847
Plasmodium falciparum cysteine proteinase falcipain 1 0.0027 0.0031 0.2429
Trichomonas vaginalis taga, putative 0.002 0.0019 0.1107
Loa Loa (eye worm) hypothetical protein 0.0017 0.0013 0.0404
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0027 0.0031 0.2067
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Loa Loa (eye worm) fibroinase 0.0052 0.0078 0.2491
Brugia malayi ABC transporter family protein 0.002 0.0019 0.061
Onchocerca volvulus 0.0052 0.0078 0.2003
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.018 0.0321 0.9082
Loa Loa (eye worm) hypothetical protein 0.0021 0.0019 0.062
Loa Loa (eye worm) hypothetical protein 0.0176 0.0314 1
Schistosoma mansoni agrin 0.0092 0.0155 0.4955
Echinococcus multilocularis 0.0011 0.0001 0.0029
Echinococcus granulosus multidrug resistance protein 1 0.0014 0.0007 0.0237
Trypanosoma cruzi cysteine peptidase, putative 0.0197 0.0353 1
Echinococcus multilocularis expressed protein 0.0092 0.0155 0.4955
Schistosoma mansoni hypothetical protein 0.0021 0.0019 0.062
Brugia malayi Cathepsin L-like precursor 0.0052 0.0078 0.2491
Giardia lamblia Cysteinyl-tRNA synthetase 0.0077 0.0126 1
Trypanosoma cruzi cysteine proteinase, putative 0.0027 0.0031 0.0847
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Trypanosoma brucei cytochrome P450, putative 0.0029 0.0034 0.0951
Onchocerca volvulus 0.0021 0.0019 0.001
Trypanosoma cruzi cysteine peptidase, putative 0.0017 0.0013 0.0335
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Brugia malayi SPARC precursor 0.0092 0.0155 0.4955
Onchocerca volvulus 0.0052 0.0078 0.2003
Schistosoma mansoni cathepsin F (C01 family) 0.0052 0.0078 0.2491
Onchocerca volvulus 0.0021 0.0019 0.001
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Plasmodium falciparum cysteine--tRNA ligase 0.0077 0.0126 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0052 0.0078 0.5994
Onchocerca volvulus 0.0035 0.0046 0.0906
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Leishmania major cathepsin L-like protease 0.0197 0.0353 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.0011 0.0001 0.0029
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0071 0.2264
Trypanosoma cruzi cruzipain precursor, putative 0.0017 0.0013 0.0335
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.002 0.0019 0.1107
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0052 0.0078 0.5994
Loa Loa (eye worm) cytochrome P450 family protein 0.0031 0.0039 0.1234
Trichomonas vaginalis ABC transporter, half transporter, putative 0.002 0.0019 0.1107
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Brugia malayi Cathepsin L-like precursor 0.0035 0.0046 0.1461
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0013 0.0006 0.0139
Echinococcus granulosus Polycystic kidney disease protein 0.0021 0.0019 0.062
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0071 0.2264
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.002 0.0019 0.061
Trichomonas vaginalis cysteinyl-tRNA synthetase, putative 0.0077 0.0126 1
Trypanosoma cruzi cytochrome P450, putative 0.0029 0.0034 0.0951
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0052 0.0078 0.5994
Echinococcus multilocularis multidrug resistance protein 1 0.0014 0.0007 0.0237
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0046 0.1475
Schistosoma mansoni multidrug resistance protein 0.002 0.0019 0.061
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.002 0.0019 0.1107
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0092 0.0155 0.4955
Brugia malayi Papain family cysteine protease containing protein 0.0027 0.0031 0.098
Leishmania major cysteine peptidase A (CPA) 0.0052 0.0078 0.2194
Trichomonas vaginalis ABC transporter, putative 0.002 0.0019 0.1107
Brugia malayi Cathepsin L-like precursor 0.0035 0.0046 0.1461
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.002 0.0019 0.061
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Entamoeba histolytica cysteine protease, putative 0.0027 0.0031 0.2067
Entamoeba histolytica cysteine proteinase, putative 0.0052 0.0078 0.5994
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.002 0.0019 0.1107
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.002 0.0019 0.061
Loa Loa (eye worm) sodium-independent organic anion transporter 0.0176 0.0314 1
Loa Loa (eye worm) RecQ helicase 0.0025 0.0028 0.0891
Schistosoma mansoni organic anion transporter 0.0176 0.0314 1
Loa Loa (eye worm) cytochrome P450 0.0011 0.0001 0.0029
Chlamydia trachomatis cysteine--tRNA ligase 0.0077 0.0126 1
Loa Loa (eye worm) agrin synaptic family protein 0.0092 0.0155 0.4955
Leishmania major cathepsin L-like protease 0.0052 0.0078 0.2194
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.002 0.0019 0.061
Brugia malayi cathepsin L-like precursor 0.0035 0.0046 0.1461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0197 0.0353 1
Echinococcus granulosus cathepsin l1 0.0035 0.0046 0.1461

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) = 41.3 uM Cytotoxicity against human A549 cells after 72 hrs by SRB assay ChEMBL. 23964677

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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