Detailed information for compound 1390223

Basic information

Technical information
  • TDR Targets ID: 1390223
  • Name: 6,7-dimethoxy-3-[(5S)-4-methoxy-6-methyl-7,8- dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-i um-5-yl]-3H-2-benzofuran-1-one chloride
  • MW: 449.881 | Formula: C22H24ClNO7
  • H donors: 0 H acceptors: 1 LogP: 3.51 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc2c(c1OC)C(=O)OC2[C@H]1N(C)CCc2c1c(OC)c1c(c2)OCO1.Cl
  • InChi: 1S/C22H23NO7.ClH/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18;/h5-6,9,17-18H,7-8,10H2,1-4H3;1H/t17-,18?;/m0./s1
  • InChiKey: MFLVZFXCSKVCSH-OQICONIUSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6,7-dimethoxy-3-[(5S)-4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]-3H-isobenzofuran-1-one chloride
  • 912-60-7
  • 1(3H)ISOBENZOFURANONE, 6,7-DIMETHOXY-3-(5,6,7,8-TETRAHYDRO-4-METHOXY-6-METHYL-1,
  • 1(3H)Isobenzofuranone, 6,7-dimethoxy-3-(5,6,7,8-tetrahydro-4-methoxy-6-methyl-1,3-dioxolo(4,5-g)isoquinolin-5-yl)-, hydrochloride, (S-(R*,S*))-
  • 1-alpha-Narcotine hydrochloride
  • Coscopin hydrochloride
  • Coscotabs hydrochloride
  • Difmetus Kapseln
  • EINECS 213-014-9
  • Germose Noscapine
  • Key-tusscapine hydrochloride
  • Lyobex retard
  • Methoxyhydrastine hydrochloride
  • NSC 5366 hydrochloride
  • Narcompren hydrochloride
  • Narcosine hydrochloride
  • Narcotine, hydrochloride (8CI)
  • Nectadon hydrochloride
  • Noscapine hydrochloride
  • Noscapine hydrochloride [JAN]
  • Opian hydrochloride
  • Opianine hydrochloride
  • Stilco
  • Teletux
  • Terbenol hydrochloride
  • Tucotine
  • Tussicure P
  • Vadebex hydrochloride
  • Capval
  • Longatin
  • Narcotussin
  • Nipaxon
  • Tusscapine
  • Tulisan

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens Bloom syndrome, RecQ helicase-like Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0023 0.0025 0.0033
Echinococcus granulosus hemicentin 1 0.0042 0.01 0.0152
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Brugia malayi Fibronectin type III domain containing protein 0.0072 0.0224 0.0353
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0056 0.0161 0.0248
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Loa Loa (eye worm) immunoglobulin domain-containing protein 0.0023 0.0025 0.0039
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.1553 0.6314 1
Schistosoma mansoni septate junction protein 0.0042 0.01 0.0152
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0257 0.0985 0.1559
Schistosoma mansoni nephrin 0.0042 0.01 0.0152
Trichomonas vaginalis esterase, putative 0.0043 0.0108 0.0261
Echinococcus multilocularis neuroglian 0.009 0.0299 0.0467
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0054 0.0032
Brugia malayi dihydrofolate reductase family protein 0.1553 0.6314 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Mycobacterium ulcerans thymidylate synthase 0.1483 0.6024 0.9532
Loa Loa (eye worm) RecQ helicase 0.0026 0.0035 0.0054
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.1553 0.6314 1
Mycobacterium tuberculosis Hypothetical protein 0.0705 0.2829 0.4384
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0042 0.01 0.0152
Echinococcus granulosus epidermal growth factor receptor 0.009 0.0301 0.047
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Echinococcus multilocularis roundabout 2 0.0042 0.01 0.0152
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.245 1 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0108 0.0261
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Schistosoma mansoni cell adhesion molecule 0.0095 0.032 0.05
Echinococcus multilocularis hemicentin 1 0.0042 0.01 0.0152
Echinococcus granulosus contactin 0.0042 0.01 0.0152
Echinococcus multilocularis hemicentin 1 0.0042 0.01 0.0152
Brugia malayi Prion-like- 0.0042 0.01 0.0158
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0042 0.01 0.0152
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Schistosoma mansoni tyrosine kinase 0.0083 0.0271 0.0422
Onchocerca volvulus 0.0154 0.0564 0.093
Echinococcus granulosus netrin receptor unc 5 0.0023 0.0025 0.0033
Schistosoma mansoni tyrosine kinase 0.0083 0.0271 0.0422
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0023 0.0025 0.0039
Loa Loa (eye worm) beta-lactamase 0.0043 0.0108 0.0169
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0108 0.0164
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0108 0.0164
Brugia malayi hypothetical protein 0.0705 0.2829 0.4479
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Loa Loa (eye worm) hypothetical protein 0.003 0.0054 0.0085
Echinococcus granulosus insulin receptor 0.0056 0.0161 0.0248
Schistosoma mansoni peripheral-type benzodiazepine receptor 0.0292 0.1128 0.1781
Leishmania major hypothetical protein, conserved 0.0043 0.0108 0.0054
Onchocerca volvulus 0.0292 0.1128 0.1867
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Echinococcus granulosus Immunoglobulin 0.0023 0.0025 0.0033
Schistosoma mansoni tyrosine kinase 0.0083 0.0271 0.0422
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0108 0.0169
Echinococcus granulosus twitchin 0.009 0.0299 0.0467
Echinococcus granulosus roundabout 2 0.0113 0.0395 0.0619
Loa Loa (eye worm) hypothetical protein 0.0023 0.0025 0.0039
Brugia malayi basement membrane proteoglycan precursor 0.0023 0.0025 0.0039
Schistosoma mansoni tyrosine kinase 0.0056 0.0161 0.0248
Brugia malayi Prion-like- 0.0018 0.0004 0.0006
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Echinococcus granulosus translocator protein 0.0292 0.1128 0.1781
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0023 0.0025 0.0033
Brugia malayi hypothetical protein 0.003 0.0054 0.0085
Brugia malayi kettin 0.0018 0.0004 0.0006
Schistosoma mansoni cell adhesion molecule 0.0042 0.01 0.0152
Echinococcus multilocularis leucine rich repeat containing protein 4 0.0023 0.0025 0.0033
Echinococcus granulosus microtubule associated protein 2 0.0833 0.3354 0.5309
Echinococcus multilocularis peroxidasin 0.0042 0.01 0.0152
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0108 0.0054
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.245 1 1
Schistosoma mansoni neuroglian 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0023 0.0025 0.0033
Brugia malayi protein unc-22 0.0018 0.0004 0.0006
Schistosoma mansoni cell adhesion molecule 0.0023 0.0025 0.0033
Brugia malayi thymidylate synthase 0.1483 0.6024 0.954
Loa Loa (eye worm) hypothetical protein 0.0023 0.0025 0.0039
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0108 0.0261
Schistosoma mansoni cell adhesion molecule 0.0042 0.01 0.0152
Brugia malayi Protein kinase domain containing protein 0.0056 0.0161 0.0254
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Schistosoma mansoni nephrin related 0.0023 0.0025 0.0033
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0108 0.0261
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0063 0.0098
Schistosoma mansoni basigin related 0.0023 0.0025 0.0033
Loa Loa (eye worm) projectin 0.0018 0.0004 0.0006
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0025 0.0039
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0108 0.0169
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0705 0.2829 0.2789
Loa Loa (eye worm) TK/INSR protein kinase 0.0056 0.0161 0.0254
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.1483 0.6024 0.9532
Schistosoma mansoni cell adhesion molecule 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0025 0.0039
Loa Loa (eye worm) hypothetical protein 0.0033 0.0063 0.0098
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Brugia malayi Immunoglobulin domain containing protein 0.0023 0.0025 0.0039
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0072 0.0224 0.0348
Loa Loa (eye worm) hypothetical protein 0.0023 0.0025 0.0039
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0042 0.01 0.0158
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0108 0.0107
Schistosoma mansoni dihydrofolate reductase 0.1553 0.6314 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0072 0.0224 0.0353
Brugia malayi Peroxidasin 0.0042 0.01 0.0158
Echinococcus granulosus lamin dm0 0.0033 0.0063 0.0093
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus low density lipoprotein receptor ldl 0.0023 0.0025 0.0033
Echinococcus multilocularis tyrosine protein kinase otk 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.1071 0.1552
Echinococcus granulosus geminin 0.0205 0.077 0.1214
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Chlamydia trachomatis dihydrofolate reductase 0.1553 0.6314 0.5
Onchocerca volvulus 0.1483 0.6024 1
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0063 0.0098
Schistosoma mansoni tyrosine kinase 0.0163 0.0598 0.0941
Echinococcus multilocularis dihydrofolate reductase 0.1553 0.6314 1
Schistosoma mansoni tyrosine kinase 0.009 0.0301 0.047
Echinococcus multilocularis roundabout 2 0.0042 0.01 0.0152
Echinococcus multilocularis Immunoglobulin 0.0023 0.0025 0.0033
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Schistosoma mansoni vesicular amine transporter 0.0072 0.0224 0.0348
Echinococcus granulosus peroxidasin 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Schistosoma mansoni hypothetical protein 0.0205 0.077 0.1214
Brugia malayi intermediate filament protein 0.0033 0.0063 0.0098
Echinococcus granulosus intermediate filament protein 0.0033 0.0063 0.0093
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0108 0.0164
Echinococcus granulosus survival motor neuron protein 1 0.0286 0.1103 0.1741
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Echinococcus multilocularis pro neuregulin 2, membrane bound 0.0023 0.0025 0.0033
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus basement membrane specific heparan sulfate 0.0023 0.0025 0.0033
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.3354 0.5309
Brugia malayi Heparan sulfate 0.0023 0.0025 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.0705 0.2829 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Brugia malayi Immunoglobulin I-set domain containing protein 0.0257 0.0985 0.1559
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0023 0.0025 0.0033
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Schistosoma mansoni septate junction protein 0.0023 0.0025 0.0033
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.245 1 1
Schistosoma mansoni lamin 0.0033 0.0063 0.0093
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Echinococcus multilocularis Immunoglobulin subtype 0.0023 0.0025 0.0033
Loa Loa (eye worm) hypothetical protein 0.0113 0.0395 0.0624
Onchocerca volvulus 0.0292 0.1128 0.1867
Echinococcus multilocularis Immunoglobulin 0.0023 0.0025 0.0033
Echinococcus multilocularis Immunoglobulin 0.0072 0.0224 0.0348
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0072 0.0224 0.0348
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0058 0.0169 0.0266
Loa Loa (eye worm) disorganized muscle protein 1 0.0018 0.0004 0.0006
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0042 0.01 0.0158
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0023 0.0025 0.0033
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0108 0.0164
Echinococcus multilocularis translocator protein 0.0292 0.1128 0.1781
Schistosoma mansoni septate junction protein 0.0023 0.0025 0.0033
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0054 0.0054
Loa Loa (eye worm) hypothetical protein 0.0292 0.1128 0.1785
Brugia malayi Immunoglobulin domain containing protein 0.0023 0.0025 0.0039
Brugia malayi hypothetical protein 0.0072 0.0224 0.0353
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0025 0.0039
Echinococcus granulosus Immunoglobulin subtype 0.0023 0.0025 0.0033
Echinococcus multilocularis lachesin 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Brugia malayi hypothetical protein 0.0118 0.0413 0.0653
Brugia malayi Leucine Rich Repeat family protein 0.0018 0.0004 0.0006
Onchocerca volvulus Basement membrane proteoglycan homolog 0.0042 0.01 0.016
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.009 0.0301 0.047
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Schistosoma mansoni septate junction protein 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0292 0.1128 0.1785
Brugia malayi Immunoglobulin domain containing protein 0.0023 0.0025 0.0039
Loa Loa (eye worm) CAMK protein kinase 0.0018 0.0004 0.0006
Schistosoma mansoni netrin receptor unc5 0.0023 0.0025 0.0033
Schistosoma mansoni cell adhesion molecule 0.0023 0.0025 0.0033
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0042 0.01 0.0152
Brugia malayi Prion-like- 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus tyrosine protein kinase otk 0.0042 0.01 0.0152
Echinococcus multilocularis geminin 0.0205 0.077 0.1214
Schistosoma mansoni intermediate filament proteins 0.0033 0.0063 0.0093
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0023 0.0025 0.0033
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0072 0.0224 0.0348
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0042 0.01 0.0152
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.3354 0.5309
Loa Loa (eye worm) one IG domain family member 0.0018 0.0004 0.0006
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0023 0.0025 0.0039
Schistosoma mansoni tyrosine kinase 0.0056 0.0161 0.0248
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Onchocerca volvulus Tyrosine kinase homolog 0.018 0.067 0.1105
Echinococcus multilocularis insulin receptor 0.0056 0.0161 0.0248
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0095 0.032 0.05
Schistosoma mansoni netrin receptor unc5 0.0023 0.0025 0.0033
Loa Loa (eye worm) hypothetical protein 0.0021 0.0014 0.002
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0042 0.01 0.0158
Mycobacterium ulcerans tryptophan-rich sensory protein 0.0292 0.1128 0.1644
Loa Loa (eye worm) hypothetical protein 0.0023 0.0025 0.0039
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0042 0.01 0.0152
Echinococcus multilocularis thymidylate synthase 0.1483 0.6024 0.954
Echinococcus granulosus Immunoglobulin 0.0023 0.0025 0.0033
Echinococcus granulosus epidermal growth factor receptor 0.0163 0.0598 0.0941
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0023 0.0025 0.0033
Onchocerca volvulus 0.0043 0.0108 0.0172
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0042 0.01 0.0152
Onchocerca volvulus 0.0033 0.0063 0.0097
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0042 0.01 0.0158
Brugia malayi Dihydrofolate reductase 0.1553 0.6314 1
Loa Loa (eye worm) hypothetical protein 0.0292 0.1128 0.1785
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.1483 0.6024 0.9532
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.245 1 1
Echinococcus multilocularis lamin 0.0033 0.0063 0.0093
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Brugia malayi Myb-like DNA-binding domain containing protein 0.0018 0.0004 0.0006
Schistosoma mansoni hypothetical protein 0.0023 0.0025 0.0033
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0108 0.0261
Brugia malayi beta-lactamase family protein 0.0043 0.0108 0.0169
Loa Loa (eye worm) TK/EGFR protein kinase 0.0163 0.0598 0.0946
Echinococcus multilocularis lamin dm0 0.0033 0.0063 0.0093
Echinococcus granulosus bloom syndrome protein 0.0026 0.0035 0.0049
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Brugia malayi Prion-like- 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Brugia malayi beta-lactamase family protein 0.0043 0.0108 0.0169
Schistosoma mansoni titin 0.0042 0.01 0.0152
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Schistosoma mansoni blooms syndrome DNA helicase 0.002 0.0013 0.0013
Echinococcus granulosus defective proboscis extension response 0.0072 0.0224 0.0348
Brugia malayi Animal haem peroxidase family protein 0.0018 0.0004 0.0006
Echinococcus granulosus neuroglian 0.009 0.0299 0.0467
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Echinococcus granulosus 3'partial|cell adhesion molecule:down regulated by 0.0023 0.0025 0.0033
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0026 0.0035 0.0048
Schistosoma mansoni survival motor neuron protein 0.0058 0.0169 0.026
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Onchocerca volvulus 0.0043 0.0108 0.0172
Loa Loa (eye worm) hypothetical protein 0.0292 0.1128 0.1785
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0026 0.0035 0.0048
Onchocerca volvulus 0.0043 0.0108 0.0172
Loa Loa (eye worm) TK protein kinase 0.0026 0.0035 0.0054
Brugia malayi hypothetical protein 0.0286 0.1103 0.1746
Schistosoma mansoni tyrosine kinase 0.0049 0.0131 0.02
Loa Loa (eye worm) animal heme peroxidase 0.0018 0.0004 0.0006
Echinococcus multilocularis cell adhesion molecule:down regulated by 0.0023 0.0025 0.0033
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Brugia malayi TspO/MBR family protein 0.0292 0.1128 0.1785
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Echinococcus granulosus lachesin 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Echinococcus multilocularis bloom syndrome protein 0.0026 0.0035 0.0049
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.1483 0.6024 0.954
Echinococcus multilocularis low density lipoprotein receptor (ldl) 0.0023 0.0025 0.0033
Schistosoma mansoni nephrin 0.009 0.0299 0.0467
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Brugia malayi Disorganized muscle protein 1 0.0018 0.0004 0.0006
Schistosoma mansoni lamin 0.0033 0.0063 0.0093
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Schistosoma mansoni roundabout 0.0042 0.01 0.0152
Loa Loa (eye worm) hypothetical protein 0.0113 0.0395 0.0624
Loa Loa (eye worm) hypothetical protein 0.0286 0.1103 0.1746
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0054 0.0032
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.245 1 1
Echinococcus multilocularis epidermal growth factor receptor 0.0163 0.0598 0.0941
Echinococcus multilocularis musashi 0.0033 0.0063 0.0093
Echinococcus multilocularis Immunoglobulin 0.0072 0.0224 0.0348
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) hypothetical protein 0.0095 0.032 0.0505
Onchocerca volvulus 0.0292 0.1128 0.1867
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Brugia malayi hypothetical protein 0.002 0.001 0.0014
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0056 0.0161 0.0248
Schistosoma mansoni peroxidasin 0.0023 0.0025 0.0033
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0108 0.0054
Loa Loa (eye worm) thymidylate synthase 0.1483 0.6024 0.954
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0108 0.0261
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.1553 0.6314 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.01 0.0158
Brugia malayi Immunoglobulin I-set domain containing protein 0.0026 0.0035 0.0054
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Brugia malayi hypothetical protein 0.0023 0.0025 0.0039
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0025 0.0039
Echinococcus granulosus roundabout 2 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Echinococcus granulosus lamin 0.0033 0.0063 0.0093
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus thymidylate synthase 0.1483 0.6024 0.954
Brugia malayi Bloom's syndrome protein homolog 0.0026 0.0035 0.0054
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0018 0.0004 0.0006
Schistosoma mansoni basigin related 0.0023 0.0025 0.0033
Echinococcus multilocularis neuroglian 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Echinococcus granulosus pro neuregulin 2 membrane bound 0.0023 0.0025 0.0033
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Brugia malayi beta-lactamase 0.0043 0.0108 0.0169
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus roundabout 2 0.0042 0.01 0.0152
Echinococcus granulosus neuroglian 0.0042 0.01 0.0152
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Loa Loa (eye worm) dihydrofolate reductase 0.1553 0.6314 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Brugia malayi Wrapper/rega-1/klingon homolog protein 1 0.0018 0.0004 0.0006
Onchocerca volvulus 0.0033 0.0063 0.0097
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.0025 0.0039
Schistosoma mansoni basigin related 0.0023 0.0025 0.0033
Echinococcus multilocularis survival motor neuron protein 1 0.0286 0.1103 0.1741
Echinococcus granulosus dihydrofolate reductase 0.1553 0.6314 1
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0054 0.0054
Echinococcus multilocularis roundabout 2 0.0113 0.0395 0.0619
Onchocerca volvulus 0.0292 0.1128 0.1867
Schistosoma mansoni tyrosine kinase 0.009 0.0301 0.047
Loa Loa (eye worm) hypothetical protein 0.0072 0.0224 0.0353
Loa Loa (eye worm) TK/ROR protein kinase 0.0026 0.0035 0.0054
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0023 0.0025 0.0033
Brugia malayi Immunoglobulin I-set domain containing protein 0.0042 0.01 0.0158
Brugia malayi Furin-like cysteine rich region family protein 0.0163 0.0598 0.0946
Schistosoma mansoni hypothetical protein 0.0205 0.077 0.1214
Echinococcus multilocularis epidermal growth factor receptor 0.009 0.0301 0.047
Brugia malayi basement membrane proteoglycan 0.0023 0.0025 0.0039
Loa Loa (eye worm) hypothetical protein 0.0043 0.0108 0.0169
Echinococcus multilocularis netrin receptor unc 5 0.0023 0.0025 0.0033
Echinococcus multilocularis 0.0048 0.0128 0.0196
Loa Loa (eye worm) hypothetical protein 0.0018 0.0004 0.0006
Echinococcus granulosus Immunoglobulin 0.0072 0.0224 0.0348
Loa Loa (eye worm) LAD-2 short isoform 0.0023 0.0025 0.0039
Onchocerca volvulus 0.0058 0.0169 0.0273
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0063 0.0098
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0108 0.0054
Loa Loa (eye worm) hypothetical protein 0.0032 0.0061 0.0095
Schistosoma mansoni hypothetical protein 0.0058 0.0169 0.026
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.0004 0.0006
Toxoplasma gondii ABC1 family protein 0.0043 0.0108 0.0108

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.5623 um PUBCHEM_BIOASSAY: qHTS Validation Assay for Inhibitors of Bloom's syndrome helicase (BLM). (Class of assay: confirmatory) [Related pubchem assays: 593 (Fluorescein region spectral profiling screen), 594 (Rhodamine region spectral profiling screen)] ChEMBL. No reference
Potency (functional) = 0.5623 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bloom's syndrome helicase (BLM). (Class of assay: confirmatory) [Related pubchem assays: 593 (Fluorescein region spectral profiling screen), 2386 (Probe Development Summary for Inhibitors of Bloom's syndrome helicase (BLM)), 594 (Rhodamine region spectral profiling screen), 2364 (qHTS Validation Assay for Inhibitors of Bloom's syndrome helicase (BLM))] ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Quantitative high throughput screen for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774] ChEMBL. No reference
Potency (functional) 18.3564 uM PUBCHEM_BIOASSAY: Validation screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463097, AID463113, AID493165, AID493166, AID504806, AID504809] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Quantitative high throughput screen for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488774] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 67.4555 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Human Peripheral Myelin Protein 22 (PMP22) Expression/Activity. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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