Detailed information for compound 410331

Basic information

Technical information
  • TDR Targets ID: 410331
  • Name: 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitroind eno[1,2-c]isoquinoline-5,11-dione
  • MW: 439.418 | Formula: C22H21N3O7
  • H donors: 1 H acceptors: 4 LogP: 1.54 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: NCCCn1c2c3c(OC)c(OC)c(cc3C(=O)c2c2c(c1=O)cc(cc2)[N+](=O)[O-])OC
  • InChi: 1S/C22H21N3O7/c1-30-15-10-14-17(21(32-3)20(15)31-2)18-16(19(14)26)12-6-5-11(25(28)29)9-13(12)22(27)24(18)8-4-7-23/h5-6,9-10H,4,7-8,23H2,1-3H3
  • InChiKey: PXEMKFFENAQBRD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione
  • 6-(3-azanylpropyl)-7,8,9-trimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione
  • 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-quinone
  • 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitroindeno[3,2-c]isoquinoline-5,11-dione
  • 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitro-indeno[3,2-c]isoquinoline-5,11-dione
  • 6-(3-aminopropyl)-7,8,9-trimethoxy-3-nitro-indeno[3,2-c]isoquinoline-5,11-quinone

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
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0009 0.2112 0.5647
Brugia malayi G protein-coupled receptor F59B2.13 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.374 1
Schistosoma mansoni neuropeptide F-like receptor 0.0009 0.2112 0.5647
Schistosoma mansoni neuropeptide receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni cathepsin F (C01 family) 0.0006 0.0162 0.0432
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0012 0.374 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Echinococcus multilocularis g-protein coupled receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Echinococcus granulosus dro:myosuppressin receptor 0.0009 0.2112 0.5647
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0009 0.2112 0.5647
Echinococcus granulosus FTZ F1 alpha 0.0012 0.374 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.374 1
Schistosoma mansoni adenoreceptor 0.0009 0.2112 0.5647
Brugia malayi Dopamine receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis g protein coupled receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0006 0.0162 0.0432
Schistosoma mansoni nuclear hormone receptor 0.0012 0.374 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0009 0.2112 0.5647
Leishmania major cathepsin L-like protease 0.0022 1 1
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.04 0.1071
Loa Loa (eye worm) G-protein coupled receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0009 0.2112 0.5647
Schistosoma mansoni myosin xvIII 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0006 0.0162 0.0432
Echinococcus granulosus neuropeptide s receptor 0.0009 0.2112 0.5647
Echinococcus granulosus peptide allatostatin:somatostatin 0.0009 0.2112 0.5647
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0009 0.2112 0.5647
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.374 1
Onchocerca volvulus 0.0009 0.2112 0.5647
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.002 0.8843 0.8824
Leishmania major cathepsin L-like protease 0.0022 1 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.374 1
Echinococcus multilocularis neuropeptide receptor 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0006 0.0162 0.0432
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine (5HT) receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis sex peptide receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis fmrfamide receptor 0.0009 0.2112 0.5647
Entamoeba histolytica cysteine protease, putative 0.0006 0.0162 0.5
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus granulosus neuropeptides capa receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni histamine h1 receptor 0.0009 0.2112 0.5647
Brugia malayi Dopamine receptor protein 1 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.374 1
Brugia malayi nuclear receptor NHR-88 0.0012 0.374 1
Echinococcus granulosus neuropeptide Y receptor 0.0009 0.2112 0.5647
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.374 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni neuropeptide receptor 0.0009 0.2112 0.5647
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus granulosus g-protein coupled receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0009 0.2112 0.5647
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.374 1
Brugia malayi neuropeptide F receptor 0.0009 0.2112 0.5647
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.2112 0.5647
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.374 1
Echinococcus multilocularis neuropeptide receptor 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptide receptor 0.0009 0.2112 0.5647
Schistosoma mansoni hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.374 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0006 0.0162 0.0432
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Schistosoma mansoni opsin-like receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0006 0.0162 0.0432
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0006 0.0162 0.0432
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.374 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.374 1
Trypanosoma cruzi cruzipain precursor, putative 0.0022 1 1
Schistosoma mansoni neuropeptide F-like receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis cysteine protease 0.0006 0.0162 0.0432
Plasmodium vivax vivapain-2 0.0006 0.0162 0.5
Echinococcus granulosus cathepsin l1 0.0006 0.0162 0.0432
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni opsin-like receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Brugia malayi GnHR receptor homolog 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptide Y receptor 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.374 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.374 1
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi larval opioid receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.374 1
Echinococcus granulosus serotonin receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis somatostatin receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) cysteine protease 0.0006 0.0162 0.0432
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0009 0.2112 0.5647
Schistosoma mansoni growth hormone secretagogue receptor 0.0009 0.2112 0.5647
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Schistosoma mansoni cathepsin F (C01 family) 0.0006 0.0162 0.0432
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0009 0.2112 0.5647
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0006 0.0162 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.374 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Entamoeba histolytica cysteine proteinase, putative 0.0006 0.0162 0.5
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis neuropeptide Y receptor 0.0009 0.2112 0.5647
Brugia malayi G protein-coupled receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus granulosus tachykinin peptides receptor 99D 0.0009 0.2112 0.5647
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.2112 0.5647
Echinococcus granulosus hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis g protein coupled receptor 0.0009 0.2112 0.5647
Schistosoma mansoni amine GPCR 0.0009 0.2112 0.5647
Echinococcus multilocularis serotonin receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis neuropeptides capa receptor 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptide receptor 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.374 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Brugia malayi G-protein coupled receptor 0.0009 0.2112 0.5647
Brugia malayi putative neuropeptide receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0006 0.04 0.1071
Echinococcus granulosus cathepsin L cysteine proteinase 0.0006 0.0162 0.0432
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0006 0.0162 0.0432
Brugia malayi nuclear receptor RXR 0.0006 0.04 0.1071
Schistosoma mansoni neuropeptide f receptor 76f 0.0009 0.2112 0.5647
Brugia malayi ecdysteroid receptor 0.0012 0.374 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.374 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.374 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0009 0.2112 0.5647
Toxoplasma gondii cathepsin CPL 0.0006 0.0162 0.5
Onchocerca volvulus 0.0009 0.2112 0.5647
Schistosoma mansoni coup transcription factor 0.0012 0.374 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.374 1
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Plasmodium vivax vivapain-2 0.0006 0.0162 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0006 0.0162 0.0432
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.374 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0006 0.04 0.1071
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Schistosoma mansoni biogenic amine receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine receptor 0.0009 0.2112 0.5647
Echinococcus granulosus G protein coupled receptor 139 0.0009 0.2112 0.5647
Echinococcus granulosus allatostatin A receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Entamoeba histolytica cysteine proteinase, putative 0.0006 0.0162 0.5
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi follicle stimulating hormone receptor 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Brugia malayi Serotonin receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) neuropeptide F receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis G protein coupled receptor 139 0.0009 0.2112 0.5647
Schistosoma mansoni thyroid hormone receptor 0.0012 0.374 1
Echinococcus multilocularis neuropeptide receptor A26 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0009 0.2112 0.5647
Brugia malayi nuclear hormone receptor 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0006 0.04 0.1071
Echinococcus granulosus biogenic amine 5HT receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Onchocerca volvulus Protein ultraspiracle homolog 0.0012 0.374 1
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0006 0.0162 0.0432
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni alpha-1 adrenergic receptor 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.374 1
Trypanosoma cruzi cysteine peptidase, putative 0.0022 1 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus granulosus g protein coupled receptor 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Onchocerca volvulus Cathepsin L homolog 0.0006 0.0162 0.0432
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.374 1
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0006 0.04 0.1071
Echinococcus multilocularis G-protein coupled receptor, putative 0.0009 0.2112 0.5647
Echinococcus multilocularis cathepsin L cysteine protease 0.0006 0.0162 0.0432
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0009 0.2112 0.5647
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.374 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0009 0.2112 0.5647
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.374 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Brugia malayi G-protein coupled receptor 0.0009 0.2112 0.5647
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus 7TM GPCR rhodopsin 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0009 0.2112 0.5647
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.374 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni neuropeptide receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.374 1
Onchocerca volvulus Bile acid receptor homolog 0.0012 0.374 1
Loa Loa (eye worm) fibroinase 0.0006 0.0162 0.0432
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.374 1
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Brugia malayi Dopamine receptor protein 2 0.0009 0.2112 0.5647
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0009 0.2112 0.5647
Echinococcus granulosus orexin receptor type 2 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni opsin-like receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis fmrfamide receptor 0.0009 0.2112 0.5647
Plasmodium falciparum cysteine proteinase falcipain 3 0.0006 0.0162 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.374 1
Echinococcus multilocularis serotonin receptor 0.0009 0.2112 0.5647
Brugia malayi sulfakinin receptor protein 0.0009 0.2112 0.5647
Schistosoma mansoni hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptide FF receptor 2 0.0009 0.2112 0.5647
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0009 0.2112 0.5647
Trypanosoma cruzi major cysteine proteinase, putative 0.0018 0.7145 0.7098
Loa Loa (eye worm) hypothetical protein 0.0006 0.0162 0.0432
Onchocerca volvulus 0.0006 0.0162 0.0432
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma cruzi cysteine peptidase, putative 0.0022 1 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0009 0.2112 0.5647
Echinococcus granulosus fmrfamide receptor 0.0009 0.2112 0.5647
Schistosoma mansoni neuropeptide receptor 0.0009 0.2112 0.5647
Brugia malayi neuropeptide F receptor 0.0009 0.2112 0.5647
Onchocerca volvulus Neuropeptide F receptor homolog 0.0009 0.2112 0.5647
Brugia malayi AKH receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) neuropeptide F receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptide receptor A26 0.0009 0.2112 0.5647
Echinococcus granulosus 7tm_1 domain containing protein 0.0009 0.2112 0.5647
Brugia malayi putative neuropeptide receptor NPR1 0.0009 0.2112 0.5647
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.2112 0.5647
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0009 0.2112 0.5647
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.374 1
Loa Loa (eye worm) G-protein coupled receptor 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0006 0.0162 0.5
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0006 0.04 0.1071
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.374 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) melatonin receptor type 1A 0.0009 0.2112 0.5647
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus multilocularis cysteine protease 0.0006 0.0162 0.0432
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus multilocularis dro:myosuppressin receptor 0.0009 0.2112 0.5647
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0006 0.04 0.1071
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus multilocularis allatostatin A receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) TYRA-2 protein 0.0009 0.2112 0.5647
Schistosoma mansoni amine GPCR 0.0009 0.2112 0.5647
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0006 0.0162 0.5
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0009 0.2112 0.5647
Onchocerca volvulus Cathepsin F homolog 0.0006 0.0162 0.0432
Schistosoma mansoni amine GPCR 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Echinococcus multilocularis g protein coupled receptor 0.0009 0.2112 0.5647
Echinococcus granulosus neuropeptides capa receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.374 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.374 1
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0022 1 0.5
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.374 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Echinococcus multilocularis cathepsin L cysteine protease 0.0006 0.0162 0.0432
Echinococcus multilocularis neuropeptide Y receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0006 0.0162 0.0432
Schistosoma mansoni thyroid hormone receptor 0.0012 0.374 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.2112 0.5647
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0006 0.04 0.1071
Schistosoma mansoni hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.374 1
Echinococcus multilocularis neuropeptides capa receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.374 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0006 0.0162 0.5
Brugia malayi ORL1-like opioid receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.374 1
Onchocerca volvulus 0.0009 0.2112 0.5647
Echinococcus granulosus g protein coupled receptor 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0009 0.2112 0.5647
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.374 1
Echinococcus granulosus somatostatin receptor 0.0009 0.2112 0.5647
Brugia malayi Serotonin receptor 0.0009 0.2112 0.5647
Loa Loa (eye worm) hypothetical protein 0.0006 0.04 0.1071
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Loa Loa (eye worm) ctsf protein 0.0006 0.0162 0.0432
Echinococcus granulosus g protein coupled receptor 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0006 0.04 0.1071
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.374 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0009 0.2112 0.5647
Onchocerca volvulus Cathepsin L homolog 0.0006 0.0162 0.0432
Schistosoma mansoni amine GPCR 0.0009 0.2112 0.5647
Trypanosoma cruzi cysteine peptidase, putative 0.0022 1 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0006 0.0162 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.04 0.1071
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.374 1
Onchocerca volvulus 0.0006 0.0162 0.0432
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.374 1
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0009 0.2112 0.5647
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.374 1
Brugia malayi RE15519p 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine (5HT) receptor 0.0009 0.2112 0.5647
Echinococcus multilocularis neuropeptide s receptor 0.0009 0.2112 0.5647
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0006 0.0162 0.5
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Echinococcus granulosus sex peptide receptor 0.0009 0.2112 0.5647
Brugia malayi Papain family cysteine protease containing protein 0.0006 0.0162 0.0432
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0009 0.2112 0.5647
Schistosoma mansoni biogenic amine receptor 0.0009 0.2112 0.5647
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0006 0.04 0.1071
Brugia malayi steroid hormone receptor 0.0012 0.374 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.2112 0.5647
Brugia malayi Tachykinin-like peptides receptor 99D 0.0009 0.2112 0.5647
Brugia malayi Cathepsin L-like precursor 0.0006 0.0162 0.0432
Echinococcus multilocularis neuropeptide FF receptor 2 0.0009 0.2112 0.5647
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.374 1
Onchocerca volvulus 0.0009 0.2112 0.5647
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.374 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0009 0.2112 0.5647
Schistosoma mansoni amine GPCR 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0009 0.2112 0.5647
Brugia malayi hypothetical protein 0.0006 0.04 0.1071
Brugia malayi Melatonin receptor type 1A 0.0009 0.2112 0.5647
Onchocerca volvulus 0.0012 0.374 1
Echinococcus multilocularis orexin receptor type 2 0.0009 0.2112 0.5647
Brugia malayi Nuclear hormone receptor-like 1 0.0006 0.04 0.1071
Onchocerca volvulus 0.0009 0.2112 0.5647

Activities

Activity type Activity value Assay description Source Reference
GI50 (ADMET) = 0.832 uM Cytotoxicity against human HCT116 cell line ChEMBL. 17181156
GI50 (ADMET) = 0.832 uM Cytotoxicity against human HCT116 cell line ChEMBL. 17181156
GI50 (ADMET) = 0.871 uM Cytotoxicity against human MDA-MB-435 cell line ChEMBL. 17181156
GI50 (ADMET) = 0.871 uM Cytotoxicity against human MDA-MB-435 cell line ChEMBL. 17181156
GI50 (ADMET) = 0.933 uM Cytotoxicity against human HOP62 cell line ChEMBL. 17181156
GI50 (ADMET) = 0.933 uM Cytotoxicity against human HOP62 cell line ChEMBL. 17181156
GI50 (ADMET) = 1.38 uM Cytotoxicity against human SF539 cell line ChEMBL. 17181156
GI50 (ADMET) = 1.38 uM Cytotoxicity against human SF539 cell line ChEMBL. 17181156
GI50 (ADMET) = 3.98 uM Cytotoxicity against human SN12C cell line ChEMBL. 17181156
GI50 (ADMET) = 3.98 uM Cytotoxicity against human SN12C cell line ChEMBL. 17181156
GI50 (ADMET) = 7.24 uM Cytotoxicity against human DU145 cell line ChEMBL. 17181156
GI50 (ADMET) = 7.24 uM Cytotoxicity against human DU145 cell line ChEMBL. 17181156
GI50 (ADMET) = 9.12 uM Cytotoxicity against human UACC62 cell line ChEMBL. 17181156
GI50 (ADMET) = 9.12 uM Cytotoxicity against human UACC62 cell line ChEMBL. 17181156
GI50 (ADMET) = 10.7 uM Cytotoxicity against human OVCAR3 cell line ChEMBL. 17181156
GI50 (ADMET) = 10.7 uM Cytotoxicity against human OVCAR3 cell line ChEMBL. 17181156

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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