Detailed information for compound 303239

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 422.601 | Formula: C24H42N2O4
  • H donors: 3 H acceptors: 2 LogP: 4.79 Rotable bonds: 18
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCC(=O)NCc1ccc(c(c1)OC)OCC(CNC(CC)C)O
  • InChi: 1S/C24H42N2O4/c1-5-7-8-9-10-11-12-24(28)26-16-20-13-14-22(23(15-20)29-4)30-18-21(27)17-25-19(3)6-2/h13-15,19,21,25,27H,5-12,16-18H2,1-4H3,(H,26,28)
  • InChiKey: AQGUVFGYLHNNMV-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Schistosoma mansoni DNA topoisomerase II 0.0142 0.1114 0.1059
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0818 0.7882 0.9584
Trypanosoma cruzi histone deacetylase, putative 0.0056 0.0259 0.0834
Schistosoma mansoni myosin xvIII 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Trypanosoma cruzi histone deacetylase 1, putative 0.0198 0.1674 0.6768
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0049 0.0187 0.0127
Echinococcus multilocularis serotonin receptor 0.0049 0.0187 0.0154
Leishmania major histone deacetylase, putative 0.0198 0.1674 0.6768
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Toxoplasma gondii aminopeptidase n, putative 0.0037 0.0061 0.0248
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Echinococcus granulosus histone deacetylase 0.0275 0.2444 0.2921
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0602 0.0663
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0049 0.0187 0.0127
Schistosoma mansoni amine GPCR 0.0049 0.0187 0.0127
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0049 0.0187 0.0154
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0037 0.0061 0.0248
Mycobacterium tuberculosis Probable oxidoreductase 0.0121 0.0905 0.2969
Loa Loa (eye worm) hypothetical protein 0.0096 0.0655 0.0598
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0142 0.1114 0.1059
Schistosoma mansoni hypothetical protein 0.0173 0.1429 0.1377
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni histamine h1 receptor 0.0049 0.0187 0.0127
Echinococcus multilocularis orexin receptor type 2 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni histone deacetylase 4 5 0.0275 0.2444 0.2398
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0159 0.1287 0.5146
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Brugia malayi AKH receptor 0.0049 0.0187 0.0127
Echinococcus granulosus neuropeptide receptor A26 0.0049 0.0187 0.0154
Leishmania major histone deacetylase, putative 0.0275 0.2444 1
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0049 0.0187 0.0127
Brugia malayi histone deacetylase 11 0.0056 0.0259 0.02
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Plasmodium vivax histone deacetylase, putative 0.0275 0.2444 1
Toxoplasma gondii aminopeptidase N, putative 0.0037 0.0061 0.0248
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis neuropeptide FF receptor 2 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.103 1 1
Echinococcus multilocularis neuropeptide s receptor 0.0049 0.0187 0.0154
Schistosoma mansoni amine GPCR 0.0049 0.0187 0.0127
Echinococcus granulosus G protein coupled receptor 139 0.0049 0.0187 0.0154
Trypanosoma cruzi histone deacetylase, putative 0.0275 0.2444 1
Schistosoma mansoni amine GPCR 0.0049 0.0187 0.0127
Plasmodium vivax DNA gyrase subunit B, putative 0.0083 0.0522 0.2136
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Schistosoma mansoni neuropeptide F-like receptor 0.0049 0.0187 0.0127
Brugia malayi hypothetical protein 0.0316 0.286 0.2816
Echinococcus granulosus 7TM GPCR rhodopsin 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus somatostatin receptor 0.0049 0.0187 0.0154
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0688 0.6578 0.6557
Schistosoma mansoni neuropeptide receptor 0.0049 0.0187 0.0127
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0096 0.0654 1
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0198 0.1674 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Brugia malayi G protein-coupled receptor 0.0049 0.0187 0.0127
Echinococcus granulosus histone deacetylase 6 0.0275 0.2444 0.2921
Echinococcus granulosus epidermal growth factor receptor 0.0152 0.1213 0.1412
Brugia malayi putative neuropeptide receptor NPR1 0.0049 0.0187 0.0127
Brugia malayi Dopamine receptor 0.0049 0.0187 0.0127
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0096 0.0654 1
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Echinococcus granulosus neuropeptide s receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0049 0.0187 0.0127
Onchocerca volvulus Neuropeptide F receptor homolog 0.0049 0.0187 0.2124
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Loa Loa (eye worm) histone deacetylase 1 0.0198 0.1674 0.1623
Schistosoma mansoni biogenic amine receptor 0.0049 0.0187 0.0127
Schistosoma mansoni tyrosine kinase 0.0152 0.1213 0.1159
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0049 0.0187 0.0154
Plasmodium falciparum histone deacetylase, putative 0.0275 0.2444 1
Brugia malayi glutathione reductase 0.0048 0.0172 0.0112
Echinococcus granulosus histone deacetylase 8 0.0056 0.0259 0.0244
Brugia malayi Furin-like cysteine rich region family protein 0.0227 0.1963 0.1914
Mycobacterium ulcerans epoxide hydrolase EphA 0.0335 0.305 1
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.0172 0.0705
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Trypanosoma brucei DNA topoisomerase ii 0.0159 0.1287 0.5146
Echinococcus multilocularis somatostatin receptor 0.0049 0.0187 0.0154
Brugia malayi ORL1-like opioid receptor 0.0049 0.0187 0.0127
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Brugia malayi putative neuropeptide receptor 0.0049 0.0187 0.0127
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0049 0.0187 0.0127
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0852 0.8221 1
Echinococcus granulosus peptide allatostatin:somatostatin 0.0049 0.0187 0.0154
Leishmania major histone deacetylase, putative 0.0198 0.1674 0.6768
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.0172 0.0565
Schistosoma mansoni neuropeptide receptor 0.0049 0.0187 0.0127
Echinococcus multilocularis allatostatin A receptor 0.0049 0.0187 0.0154
Onchocerca volvulus 0.0049 0.0187 0.2124
Trypanosoma cruzi histone deacetylase, putative 0.0056 0.0259 0.0834
Echinococcus multilocularis neuropeptide receptor 0.0049 0.0187 0.0154
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0049 0.0187 0.0127
Schistosoma mansoni growth hormone secretagogue receptor 0.0049 0.0187 0.0127
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0083 0.0522 0.2136
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0049 0.0187 0.0154
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.0083 0.0522 1
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0049 0.0187 0.0154
Brugia malayi larval opioid receptor 0.0049 0.0187 0.0127
Mycobacterium ulcerans DNA gyrase subunit B 0.0083 0.0522 0.1712
Brugia malayi sulfakinin receptor protein 0.0049 0.0187 0.0127
Echinococcus granulosus neuropeptide receptor 0.0049 0.0187 0.0154
Echinococcus granulosus neuropeptides capa receptor 0.0049 0.0187 0.0154
Echinococcus granulosus biogenic amine 5HT receptor 0.0049 0.0187 0.0154
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0049 0.0187 0.0127
Brugia malayi Protein kinase domain containing protein 0.0194 0.1636 0.1585
Schistosoma mansoni tyrosine kinase 0.0194 0.1636 0.1585
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0049 0.0187 0.0154
Onchocerca volvulus 0.0049 0.0187 0.2124
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0142 0.1114 0.129
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Echinococcus multilocularis epidermal growth factor receptor 0.0152 0.1213 0.1412
Schistosoma mansoni adenoreceptor 0.0049 0.0187 0.0127
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0121 0.0905 0.2969
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0049 0.0187 0.2124
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Brugia malayi histone deacetylase 3 (HD3) 0.0198 0.1674 0.1623
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0109 0.0784 0.257
Echinococcus granulosus tm gpcr rhodopsin 0.0049 0.0187 0.0154
Schistosoma mansoni biogenic amine (5HT) receptor 0.0049 0.0187 0.0127
Schistosoma mansoni hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0142 0.1114 0.129
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0049 0.0187 0.0127
Echinococcus granulosus tm gpcr rhodopsin 0.0852 0.8221 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Mycobacterium tuberculosis Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase) 0.0335 0.305 1
Brugia malayi Histone deacetylase family protein 0.0275 0.2444 0.2398
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus hypothetical protein 0.0049 0.0187 0.0154
Schistosoma mansoni tyrosine kinase 0.0194 0.1636 0.1585
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0058 0.0272 0.0213
Loa Loa (eye worm) G-protein coupled receptor 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis histone deacetylase 6 0.0275 0.2444 0.2921
Loa Loa (eye worm) hypothetical protein 0.0198 0.1674 0.1623
Plasmodium falciparum DNA gyrase subunit B 0.0083 0.0522 0.2136
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Toxoplasma gondii histone deacetylase HDAC4 0.0056 0.0259 0.1061
Echinococcus granulosus histone deacetylase 6 0.0275 0.2444 0.2921
Onchocerca volvulus 0.0049 0.0187 0.2124
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.0172 0.0469
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Trypanosoma cruzi histone deacetylase, putative 0.0275 0.2444 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0049 0.0187 0.0154
Schistosoma mansoni hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis neuropeptides capa receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis histone deacetylase 6 0.0275 0.2444 0.2921
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0056 0.0259 0.02
Echinococcus granulosus epidermal growth factor receptor 0.0227 0.1963 0.2331
Schistosoma mansoni histone deacetylase hda2 0.0056 0.0259 0.02
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus granulosus histone deacetylase 3 0.0198 0.1674 0.1977
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0049 0.0187 0.0127
Trypanosoma brucei histone deacetylase 2 0.0056 0.0259 0.0834
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus granulosus geminin 0.0173 0.1429 0.1677
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.0172 0.0137
Trypanosoma brucei histone deacetylase, putative 0.0275 0.2444 1
Echinococcus multilocularis neuropeptide receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Plasmodium falciparum DNA topoisomerase 2 0.0142 0.1114 0.4556
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) TOPoisomerase family member 0.0142 0.1114 0.1059
Echinococcus multilocularis histone deacetylase 0.0275 0.2444 0.2921
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus g protein coupled receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis g protein coupled receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0198 0.1674 1
Echinococcus multilocularis epidermal growth factor receptor 0.0227 0.1963 0.2331
Schistosoma mansoni histone deacetylase 4 5 0.0275 0.2444 0.2398
Schistosoma mansoni histone deacetylase 0.0198 0.1674 0.1623
Schistosoma mansoni neuropeptide receptor 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis neuropeptide Y receptor 0.0049 0.0187 0.0154
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0049 0.0187 0.0154
Echinococcus granulosus g protein coupled receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0058 0.0272 0.0213
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0049 0.0187 0.0154
Leishmania major histone deacetylase, putative 0.0275 0.2444 1
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0049 0.0187 0.0154
Schistosoma mansoni hypothetical protein 0.0049 0.0187 0.0127
Trypanosoma cruzi DNA topoisomerase II, putative 0.0134 0.1037 0.4096
Echinococcus multilocularis serotonin receptor 0.0049 0.0187 0.0154
Echinococcus granulosus histone deacetylase 1 0.0198 0.1674 0.1977
Echinococcus granulosus biogenic amine 5HT receptor 0.0049 0.0187 0.0154
Onchocerca volvulus Histone deacetylase 10 homolog 0.0056 0.0259 0.3353
Echinococcus multilocularis G protein coupled receptor 139 0.0049 0.0187 0.0154
Schistosoma mansoni hypothetical protein 0.0173 0.1429 0.1377
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0602 0.0545
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0159 0.1287 0.5146
Plasmodium vivax histone deacetylase, putative 0.0056 0.0259 0.1061
Echinococcus multilocularis fmrfamide receptor 0.0049 0.0187 0.0154
Toxoplasma gondii thioredoxin reductase 0.0048 0.0172 0.0705
Echinococcus multilocularis histone deacetylase 1 0.0198 0.1674 0.1977
Echinococcus granulosus fmrfamide receptor 0.0049 0.0187 0.0154
Plasmodium falciparum histone deacetylase 2 0.0275 0.2444 1
Toxoplasma gondii aminopeptidase N protein 0.0037 0.0061 0.0248
Schistosoma mansoni amine GPCR 0.0049 0.0187 0.0127
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0049 0.0187 0.0154
Brugia malayi GnHR receptor homolog 0.0049 0.0187 0.0127
Echinococcus granulosus tm gpcr rhodopsin 0.0049 0.0187 0.0154
Leishmania major mitochondrial DNA topoisomerase II 0.0159 0.1287 0.5146
Loa Loa (eye worm) histone deacetylase 3 0.0198 0.1674 0.1623
Loa Loa (eye worm) hypothetical protein 0.0096 0.0655 0.0598
Echinococcus multilocularis histone deacetylase 8 0.0056 0.0259 0.0244
Echinococcus granulosus orexin receptor type 2 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.103 1 1
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0096 0.0654 1
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0049 0.0187 0.0154
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0049 0.0187 0.0154
Toxoplasma gondii histone deacetylase HDAC1 0.0275 0.2444 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.0172 0.0137
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis dro:myosuppressin receptor 0.0049 0.0187 0.0154
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Plasmodium vivax glutathione reductase, putative 0.0048 0.0172 0.0705
Echinococcus multilocularis g protein coupled receptor 0.0049 0.0187 0.0154
Brugia malayi follicle stimulating hormone receptor 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0194 0.1636 0.193
Loa Loa (eye worm) hypothetical protein 0.0218 0.188 0.183
Schistosoma mansoni alpha-1 adrenergic receptor 0.0049 0.0187 0.0127
Toxoplasma gondii histone deacetylase HDAC2 0.0198 0.1674 0.6848
Echinococcus multilocularis neuropeptide Y receptor 0.0049 0.0187 0.0154
Schistosoma mansoni amine GPCR 0.0049 0.0187 0.0127
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0109 0.0784 0.257
Echinococcus granulosus insulin receptor 0.0194 0.1636 0.193
Loa Loa (eye worm) neuropeptide F receptor 0.0049 0.0187 0.0127
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0049 0.0187 0.0154
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0049 0.0187 0.0127
Brugia malayi G-protein coupled receptor 0.0049 0.0187 0.0127
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0198 0.1674 1
Trypanosoma brucei trypanothione reductase 0.0048 0.0172 0.0469
Loa Loa (eye worm) histone deacetylase 11 0.0056 0.0259 0.02
Echinococcus granulosus 7tm_1 domain containing protein 0.0049 0.0187 0.0154
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0121 0.0905 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0109 0.0784 0.8557
Echinococcus multilocularis geminin 0.0173 0.1429 0.1677
Schistosoma mansoni tyrosine kinase 0.015 0.1192 0.1138
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis neuropeptides capa receptor 0.0049 0.0187 0.0154
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Brugia malayi Thioredoxin reductase 0.0048 0.0172 0.0112
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0194 0.1636 0.193
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0049 0.0187 0.0154
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0688 0.6578 0.6557
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Trypanosoma cruzi DNA topoisomerase II, putative 0.0134 0.1037 0.4096
Onchocerca volvulus 0.0049 0.0187 0.2124
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Echinococcus granulosus serotonin receptor 0.0049 0.0187 0.0154
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0109 0.0784 0.257
Echinococcus granulosus neuropeptide receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0037 0.0061 0.0248
Echinococcus granulosus allatostatin A receptor 0.0049 0.0187 0.0154
Brugia malayi neuropeptide F receptor 0.0049 0.0187 0.0127
Brugia malayi Protein kinase domain containing protein 0.008 0.0491 0.0433
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0049 0.0187 0.0154
Toxoplasma gondii DNA topoisomerase 2, putative 0.0142 0.1114 0.4556
Brugia malayi Histone deacetylase 1 0.0198 0.1674 0.1623
Plasmodium falciparum thioredoxin reductase 0.0048 0.0172 0.0705
Brugia malayi RE15519p 0.0049 0.0187 0.0127
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0037 0.0061 0.0248
Echinococcus multilocularis g-protein coupled receptor 0.0049 0.0187 0.0154
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0049 0.0187 0.0154
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0049 0.0187 0.0127
Brugia malayi Tachykinin-like peptides receptor 99D 0.0049 0.0187 0.0127
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0049 0.0187 0.0127
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Trichomonas vaginalis histone deacetylase, putative 0.0198 0.1674 1
Brugia malayi neuropeptide F receptor 0.0049 0.0187 0.0127
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Schistosoma mansoni tyrosine kinase 0.0152 0.1213 0.1159
Leishmania major trypanothione reductase 0.0048 0.0172 0.0469
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0049 0.0187 0.0127
Brugia malayi Serotonin receptor 0.0049 0.0187 0.0127
Schistosoma mansoni tyrosine kinase 0.0227 0.1963 0.1914
Loa Loa (eye worm) hypothetical protein 0.0218 0.188 0.183
Chlamydia trachomatis DNA gyrase subunit B 0.0065 0.0348 0.6674
Schistosoma mansoni tyrosine kinase 0.015 0.1192 0.1138
Loa Loa (eye worm) hypothetical protein 0.103 1 1
Entamoeba histolytica histone deacetylase, putative 0.0198 0.1674 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0091 0.0602 0.0663
Echinococcus multilocularis G-protein coupled receptor, putative 0.0049 0.0187 0.0154
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0602 0.0663
Loa Loa (eye worm) TYRA-2 protein 0.0049 0.0187 0.0127
Echinococcus multilocularis neuropeptide receptor A26 0.0049 0.0187 0.0154
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0091 0.0602 0.0545
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0688 0.6578 0.7987
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0049 0.0187 0.0127
Trypanosoma cruzi histone deacetylase, putative 0.0275 0.2444 1
Loa Loa (eye worm) histone deacetylase 0.0275 0.2444 0.2398
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0142 0.1114 0.1059
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.0083 0.0522 1
Brugia malayi Probable DNA topoisomerase II 0.0142 0.1114 0.1059
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni neuropeptide F-like receptor 0.0049 0.0187 0.0127
Trypanosoma brucei histone deacetylase 3 0.0275 0.2444 1
Brugia malayi Melatonin receptor type 1A 0.0049 0.0187 0.0127
Schistosoma mansoni neuropeptide receptor 0.0049 0.0187 0.0127
Schistosoma mansoni neuropeptide f receptor 76f 0.0049 0.0187 0.0127
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0049 0.0187 0.0127
Echinococcus granulosus histone deacetylase 6 0.0275 0.2444 0.2921
Echinococcus granulosus neuropeptide Y receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis g protein coupled receptor 0.0049 0.0187 0.0154
Plasmodium vivax histone deacetylase 2, putative 0.0275 0.2444 1
Echinococcus granulosus sex peptide receptor 0.0049 0.0187 0.0154
Toxoplasma gondii histone deacetylase HDAC5 0.0057 0.0262 0.1071
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus dro:myosuppressin receptor 0.0049 0.0187 0.0154
Plasmodium vivax DNA topoisomerase II, putative 0.0142 0.1114 0.4556
Echinococcus granulosus tachykinin peptides receptor 99D 0.0049 0.0187 0.0154
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Plasmodium falciparum glutathione reductase 0.0048 0.0172 0.0705
Giardia lamblia Histone deacetylase 0.0198 0.1674 1
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.0172 0.0112
Loa Loa (eye worm) TK/INSR protein kinase 0.0194 0.1636 0.1585
Echinococcus granulosus g-protein coupled receptor 0.0049 0.0187 0.0154
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0049 0.0187 0.0154
Schistosoma mansoni tyrosine kinase 0.015 0.1192 0.1138
Schistosoma mansoni histone deacetylase 1 2 3 0.0056 0.0259 0.02
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0602 0.0545
Trypanosoma cruzi histone deacetylase 1, putative 0.0198 0.1674 0.6768
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0049 0.0187 0.0127
Schistosoma mansoni biogenic amine receptor 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus multilocularis fmrfamide receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) histone deacetylase 7A 0.0275 0.2444 0.2398
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0121 0.0905 0.2969
Schistosoma mansoni opsin-like receptor 0.0049 0.0187 0.0127
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Trichomonas vaginalis DNA topoisomerase II, putative 0.0142 0.1114 0.6527
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0049 0.0187 0.0127
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus neuropeptide FF receptor 2 0.0049 0.0187 0.0154
Loa Loa (eye worm) neuropeptide F receptor 0.0049 0.0187 0.0127
Brugia malayi histone deacetylase 1 (HD1) 0.0198 0.1674 0.1623
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0049 0.0187 0.0127
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni biogenic amine (5HT) receptor 0.0049 0.0187 0.0127
Mycobacterium tuberculosis Probable reductase 0.0109 0.0784 0.257
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0049 0.0187 0.0127
Mycobacterium ulcerans aminopeptidase N PepN 0.0037 0.0061 0.0199
Plasmodium falciparum histone deacetylase 1 0.0198 0.1674 0.6848
Brugia malayi Serotonin receptor 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Entamoeba histolytica DNA topoisomerase II, putative 0.0142 0.1114 0.6527
Schistosoma mansoni hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni opsin-like receptor 0.0049 0.0187 0.0127
Echinococcus granulosus histone deacetylase 7 0.0275 0.2444 0.2921
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0049 0.0187 0.0127
Mycobacterium tuberculosis Probable dehydrogenase 0.0109 0.0784 0.257
Echinococcus multilocularis rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Echinococcus multilocularis 0.0069 0.0382 0.0394
Loa Loa (eye worm) hypothetical protein 0.0641 0.6107 0.6083
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Echinococcus granulosus neuropeptide Y receptor 0.0049 0.0187 0.0154
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0109 0.0784 0.257
Plasmodium vivax histone deacetylase 1, putative 0.0198 0.1674 0.6848
Echinococcus multilocularis histone deacetylase 7 0.0275 0.2444 0.2921
Leishmania major DNA topoisomerase ii 0.0134 0.1037 0.4096
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni histone deacetylase 0.0198 0.1674 0.1623
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0091 0.0602 0.0545
Trypanosoma brucei histone deacetylase 4 0.0275 0.2444 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0091 0.0602 0.0545
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Toxoplasma gondii histone deacetylase HDAC3 0.0198 0.1674 0.6848
Loa Loa (eye worm) hypothetical protein 0.0078 0.0471 0.0412
Echinococcus multilocularis histone deacetylase 6 0.0275 0.2444 0.2921
Echinococcus multilocularis sex peptide receptor 0.0049 0.0187 0.0154
Echinococcus multilocularis histone deacetylase 3 0.0198 0.1674 0.1977
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0091 0.0602 0.0663
Onchocerca volvulus 0.0049 0.0187 0.2124
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0037 0.0061 0.0248
Onchocerca volvulus 0.0049 0.0187 0.2124
Mycobacterium ulcerans aminopeptidase N PepN 0.0037 0.0061 0.0199
Trypanosoma brucei histone deacetylase 1 0.0198 0.1674 0.6768
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0049 0.0187 0.0127
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0083 0.0522 0.1712
Schistosoma mansoni biogenic amine receptor 0.0049 0.0187 0.0127
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Onchocerca volvulus 0.0049 0.0187 0.2124
Brugia malayi Histone deacetylase family protein 0.0275 0.2444 0.2398
Loa Loa (eye worm) melatonin receptor type 1A 0.0049 0.0187 0.0127
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0134 0.1037 0.4096
Loa Loa (eye worm) G-protein coupled receptor 0.0049 0.0187 0.0127
Loa Loa (eye worm) glutathione reductase 0.0048 0.0172 0.0112
Loa Loa (eye worm) hypothetical protein 0.0049 0.0187 0.0127
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0049 0.0187 0.0127
Echinococcus granulosus alpha 1A adrenergic receptor 0.0049 0.0187 0.0154
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0049 0.0187 0.0127
Echinococcus granulosus leukotriene A 4 hydrolase 0.0688 0.6578 0.7987
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0134 0.1037 0.4096
Chlamydia trachomatis DNA gyrase subunit B 0.0083 0.0522 1
Echinococcus granulosus neuropeptides capa receptor 0.0049 0.0187 0.0154
Brugia malayi Dopamine receptor protein 2 0.0049 0.0187 0.0127
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0049 0.0187 0.0154
Schistosoma mansoni opsin-like receptor 0.0049 0.0187 0.0127
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0152 0.1213 0.1412
Brugia malayi hypothetical protein 0.0049 0.0187 0.0127
Onchocerca volvulus 0.0049 0.0187 0.2124
Echinococcus granulosus g protein coupled receptor 0.0049 0.0187 0.0154
Brugia malayi Dopamine receptor protein 1 0.0049 0.0187 0.0127
Echinococcus granulosus rhodopsin orphan GPCR 0.0049 0.0187 0.0154
Loa Loa (eye worm) TK/EGFR protein kinase 0.0227 0.1963 0.1914
Echinococcus multilocularis insulin receptor 0.0194 0.1636 0.193
Brugia malayi G-protein coupled receptor 0.0049 0.0187 0.0127
Schistosoma mansoni histone deacetylase hda2 0.0275 0.2444 0.2398

Activities

Activity type Activity value Assay description Source Reference
BP (functional) = -0.88 mmHg Blood pressure of the urethane-anesthetized normotensive Wistar rat was tested 30 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
BP (functional) = 1.22 mmHg Blood pressure of the urethane-anesthetized normotensive Wistar rat was tested 60 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
BP (functional) = 3.33 mmHg Blood pressure of the urethane-anesthetized normotensive Wistar rat was tested 15 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
BP (functional) = 4.11 mmHg Blood pressure of the urethane-anesthetized normotensive Wistar rat was tested 5 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
BP (functional) = 4.89 mmHg Blood pressure of the urethane-anesthetized normotensive Wistar rat was tested 10 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
HR (functional) = -38.56 beats min-1 Heart rate of the urethane-anesthetized normotensive Wistar rat was tested 5 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
HR (functional) = -35.44 beats min-1 Heart rate of the urethane-anesthetized normotensive Wistar rat was tested 10 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
HR (functional) = -32.33 beats min-1 Heart rate of the urethane-anesthetized normotensive Wistar rat was tested 15 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
HR (functional) = -25.11 beats min-1 Heart rate of the urethane-anesthetized normotensive Wistar rat was tested 30 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
HR (functional) = -9.56 beats min-1 Heart rate of the urethane-anesthetized normotensive Wistar rat was tested 60 min after inducing the compound on dose of 1.0 mg/kg ChEMBL. 7908697
pA2 (functional) = 6.92 Positive chronotropic effect of the compound was evaluated on atrial muscles of the guinea pig ChEMBL. 7908697
pA2 (functional) = 7.65 Positive inotropic effect of the compound was evaluated on atrial muscles of the guinea pig ChEMBL. 7908697

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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