Detailed information for compound 1394633

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 388.484 | Formula: C19H24N4O3S
  • H donors: 2 H acceptors: 3 LogP: 2.83 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1N1CCCCC1)CSCC(=O)Nc1noc(c1)C
  • InChi: 1S/C19H24N4O3S/c1-14-11-17(22-26-14)21-19(25)13-27-12-18(24)20-15-7-3-4-8-16(15)23-9-5-2-6-10-23/h3-4,7-8,11H,2,5-6,9-10,12-13H2,1H3,(H,20,24)(H,21,22,25)
  • InChiKey: LXIVXHXPOAHSLL-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
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus granulosus allatostatin A receptor 0.0037 0.0153 0.0125
Brugia malayi cahepsin L-like non-peptiedase homolog 0.0032 0.0029 0.0015
Echinococcus granulosus g-protein coupled receptor 0.0037 0.0153 0.0125
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0121 0.2292 1
Echinococcus multilocularis fmrfamide receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis g protein coupled receptor 0.0037 0.0153 0.0125
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0037 0.0153 0.0125
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0032 0.0014 0.0014
Echinococcus granulosus g protein coupled receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase, putative 0.0121 0.2292 1
Entamoeba histolytica cysteine proteinase, putative 0.0068 0.0946 0.4054
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0037 0.0153 0.0139
Schistosoma mansoni biogenic amine receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0085 0.1374 0.1374
Trypanosoma cruzi cysteine proteinase, putative 0.0068 0.0946 0.092
Onchocerca volvulus 0.0037 0.0153 0.0549
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.0153 0.0125
Echinococcus granulosus peptide allatostatin:somatostatin 0.0037 0.0153 0.0125
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0425 1 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Plasmodium vivax vivapain-2 0.0121 0.2292 1
Trypanosoma cruzi cysteine peptidase, putative 0.0036 0.0126 0.0097
Onchocerca volvulus 0.0037 0.0153 0.0549
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Onchocerca volvulus 0.0037 0.0153 0.0549
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Brugia malayi Dopamine receptor protein 1 0.0037 0.0153 0.0139
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0037 0.0153 0.0139
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0032 0.0029 0.0029
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0121 0.2292 0.2292
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0037 0.0153 0.0153
Echinococcus granulosus serotonin receptor 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0036 0.0126 0.0126
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0085 0.1374 0.1374
Loa Loa (eye worm) G-protein coupled receptor 0.0037 0.0153 0.0153
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0112 0.2056 0.2045
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Brugia malayi Papain family cysteine protease containing protein 0.0068 0.0946 0.0934
Brugia malayi cathepsin L-like precursor 0.0085 0.1374 0.1363
Loa Loa (eye worm) hypothetical protein 0.0036 0.0126 0.0126
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0037 0.0153 0.0125
Schistosoma mansoni hypothetical protein 0.0037 0.0153 0.0125
Echinococcus granulosus neuropeptide Y receptor 0.0037 0.0153 0.0125
Echinococcus granulosus 7TM GPCR rhodopsin 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Echinococcus granulosus alpha 1A adrenergic receptor 0.0037 0.0153 0.0125
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Schistosoma mansoni cathepsin F (C01 family) 0.0085 0.1374 0.135
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Schistosoma mansoni neuropeptide F-like receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0068 0.0946 0.092
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Schistosoma mansoni amine GPCR 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Plasmodium vivax vivapain-1 0.0068 0.0946 0.4054
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.0153 0.0125
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0121 0.2292 0.227
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.006 0.0103
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Entamoeba histolytica cysteine protease, putative 0.0121 0.2292 1
Echinococcus granulosus biogenic amine 5HT receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0068 0.0946 0.2976
Echinococcus multilocularis cysteine protease 0.0121 0.2292 0.227
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0032 0.0014 0.0014
Giardia lamblia Cathepsin B precursor 0.0154 0.3113 1
Echinococcus multilocularis neuropeptide receptor 0.0037 0.0153 0.0125
Schistosoma mansoni cathepsin F (C01 family) 0.0121 0.2292 0.227
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Brugia malayi Cathepsin L-like precursor 0.0085 0.1374 0.1363
Echinococcus multilocularis G-protein coupled receptor, putative 0.0037 0.0153 0.0125
Echinococcus multilocularis neuropeptide s receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0032 0.0029 0.0029
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.0153 0.0125
Brugia malayi cathepsin F-like cysteine proteinase 0.0036 0.0126 0.0112
Onchocerca volvulus Cathepsin F homolog 0.0121 0.2292 1
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0036 0.0126 0.0112
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0425 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0425 1 1
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0154 0.3113 0.3093
Onchocerca volvulus 0.0037 0.0153 0.0549
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Echinococcus multilocularis orexin receptor type 2 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Onchocerca volvulus 0.0037 0.0153 0.0549
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trypanosoma cruzi cysteine peptidase, putative 0.0121 0.2292 0.227
Echinococcus granulosus cysteine protease 0.0068 0.0946 0.092
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0032 0.0014 0.0014
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.0154 0.3113 1
Onchocerca volvulus 0.0121 0.2292 1
Brugia malayi Papain family cysteine protease containing protein 0.0068 0.0946 0.0934
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Schistosoma mansoni neuropeptide receptor 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0085 0.1374 0.4364
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Onchocerca volvulus 0.0121 0.2292 1
Echinococcus multilocularis g-protein coupled receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037 0.0153 0.0125
Brugia malayi Tachykinin-like peptides receptor 99D 0.0037 0.0153 0.0139
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0037 0.0153 0.0139
Plasmodium vivax vivapain-2 0.0121 0.2292 1
Loa Loa (eye worm) cathepsin B 0.0154 0.3113 0.3113
Echinococcus multilocularis g protein coupled receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus multilocularis cathepsin L cysteine protease 0.0121 0.2292 0.227
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Loa Loa (eye worm) fibroinase 0.0121 0.2292 0.2292
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus granulosus neuropeptide Y receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) cysteine protease 0.0121 0.2292 0.2292
Trypanosoma cruzi cysteine protease, putative 0.0068 0.0946 0.092
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) neuropeptide F receptor 0.0037 0.0153 0.0153
Echinococcus multilocularis neuropeptides capa receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0425 1 1
Echinococcus granulosus neuropeptides capa receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Echinococcus granulosus cathepsin l cysteine peptidase 0.0121 0.2292 0.227
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0037 0.0153 0.0125
Brugia malayi Serotonin receptor 0.0037 0.0153 0.0139
Loa Loa (eye worm) G-protein coupled receptor 0.0037 0.0153 0.0153
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0037 0.0153 0.0125
Onchocerca volvulus Neuropeptide F receptor homolog 0.0037 0.0153 0.0549
Echinococcus multilocularis cathepsin b 0.0425 1 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0037 0.0153 0.0139
Schistosoma mansoni myosin xvIII 0.0037 0.0153 0.0125
Echinococcus granulosus cathepsin L cysteine protease 0.0068 0.0946 0.092
Loa Loa (eye worm) glutamate receptor 0.0124 0.2351 0.2351
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Echinococcus multilocularis allatostatin A receptor 0.0037 0.0153 0.0125
Schistosoma mansoni alpha-1 adrenergic receptor 0.0037 0.0153 0.0125
Echinococcus granulosus metabotropic glutamate receptor 5 0.0152 0.3077 0.3057
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037 0.0153 0.0125
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0036 0.0121 0.0092
Schistosoma mansoni opsin-like receptor 0.0037 0.0153 0.0125
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Echinococcus granulosus orexin receptor type 2 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0152 0.3077 0.3077
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Onchocerca volvulus Cathepsin L homolog 0.0121 0.2292 1
Schistosoma mansoni neuropeptide receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0425 1 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Brugia malayi neuropeptide F receptor 0.0037 0.0153 0.0139
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0037 0.0153 0.0153
Schistosoma mansoni biogenic amine receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Onchocerca volvulus 0.0037 0.0153 0.0549
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0037 0.0153 0.0125
Echinococcus granulosus neuropeptide s receptor 0.0037 0.0153 0.0125
Trypanosoma brucei cysteine peptidase C (CPC) 0.0154 0.3113 1
Echinococcus multilocularis g protein coupled receptor 0.0037 0.0153 0.0125
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase, putative 0.0068 0.0946 0.4054
Echinococcus multilocularis neuropeptide Y receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase, putative 0.0068 0.0946 0.4054
Entamoeba histolytica cysteine proteinase, putative 0.0085 0.1374 0.5946
Brugia malayi putative neuropeptide receptor NPR1 0.0037 0.0153 0.0139
Echinococcus multilocularis fmrfamide receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi cathepsin Z-like cysteine proteinase 0.0032 0.0029 0.0015
Trypanosoma cruzi cruzipain precursor, putative 0.0036 0.0126 0.0097
Echinococcus multilocularis neuropeptide receptor A26 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase, putative 0.0121 0.2292 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Brugia malayi G-protein coupled receptor 0.0037 0.0153 0.0139
Brugia malayi Dopamine receptor 0.0037 0.0153 0.0139
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Brugia malayi Cathepsin L-like precursor 0.0085 0.1374 0.1363
Echinococcus multilocularis G protein coupled receptor 139 0.0037 0.0153 0.0125
Brugia malayi larval opioid receptor 0.0037 0.0153 0.0139
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0037 0.0153 0.0153
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0036 0.0126 0.0126
Schistosoma mansoni histamine h1 receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis sex peptide receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) TYRA-2 protein 0.0037 0.0153 0.0153
Brugia malayi cathepsin Z-like cysteine proteinase 0.0032 0.0029 0.0015
Echinococcus granulosus cathepsin l1 0.0085 0.1374 0.135
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Onchocerca volvulus 0.0037 0.0153 0.0549
Echinococcus multilocularis cathepsin b 0.0425 1 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0036 0.0121 0.0092
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Echinococcus multilocularis dro:myosuppressin receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi G-protein coupled receptor 0.0037 0.0153 0.0139
Echinococcus granulosus g protein coupled receptor 0.0037 0.0153 0.0125
Brugia malayi Papain family cysteine protease containing protein 0.0032 0.0029 0.0015
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Schistosoma mansoni amine GPCR 0.0037 0.0153 0.0125
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Brugia malayi G protein-coupled receptor 0.0037 0.0153 0.0139
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Schistosoma mansoni neuropeptide f receptor 76f 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0121 0.2292 0.2292
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Echinococcus granulosus metabotropic glutamate receptor 2 0.0104 0.1841 0.1817
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Schistosoma mansoni growth hormone secretagogue receptor 0.0037 0.0153 0.0125
Trypanosoma cruzi cysteine peptidase, putative 0.0121 0.2292 0.227
Onchocerca volvulus Cathepsin L homolog 0.0121 0.2292 1
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0036 0.0121 0.0107
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Plasmodium vivax unspecified product 0.0036 0.0126 0.0429
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Onchocerca volvulus 0.0121 0.2292 1
Echinococcus multilocularis cathepsin L 0.0068 0.0946 0.092
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.0153 0.0125
Trypanosoma cruzi cysteine peptidase, putative 0.0068 0.0946 0.092
Echinococcus granulosus fmrfamide receptor 0.0037 0.0153 0.0125
Onchocerca volvulus 0.0121 0.2292 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Onchocerca volvulus 0.0121 0.2292 1
Brugia malayi G protein-coupled receptor F59B2.13 0.0037 0.0153 0.0139
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0037 0.0153 0.0125
Schistosoma mansoni metabotropic glutamate receptor 0.0104 0.1841 0.1817
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0036 0.0121 0.0121
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0085 0.1374 0.1374
Schistosoma mansoni cathepsin F (C01 family) 0.0121 0.2292 0.227
Onchocerca volvulus 0.0121 0.2292 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0154 0.3113 0.3093
Onchocerca volvulus 0.0037 0.0153 0.0549
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0104 0.1841 0.1817
Brugia malayi metabotropic glutamate receptor type 2 0.006 0.074 0.0727
Trypanosoma cruzi cysteine peptidase, putative 0.0121 0.2292 0.227
Echinococcus multilocularis neuropeptide receptor 0.0037 0.0153 0.0125
Echinococcus granulosus neuropeptide receptor 0.0037 0.0153 0.0125
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Plasmodium falciparum cysteine proteinase falcipain 1 0.0068 0.0946 0.4054
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus granulosus G protein coupled receptor 139 0.0037 0.0153 0.0125
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0034 0.006 0.0103
Schistosoma mansoni opsin-like receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase 1, putative 0.0068 0.0946 0.4054
Schistosoma mansoni amine GPCR 0.0037 0.0153 0.0125
Trypanosoma cruzi cruzipain precursor, putative 0.0121 0.2292 0.227
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Echinococcus granulosus 7tm_1 domain containing protein 0.0037 0.0153 0.0125
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus granulosus sex peptide receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) melatonin receptor type 1A 0.0037 0.0153 0.0153
Brugia malayi Cathepsin L-like precursor 0.0036 0.0126 0.0112
Brugia malayi Metabotropic glutamate receptor precursor. 0.0124 0.2351 0.2341
Brugia malayi RE15519p 0.0037 0.0153 0.0139
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0152 0.3077 0.3057
Toxoplasma gondii cathepsin CPL 0.0121 0.2292 0.734
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0037 0.0153 0.0153
Schistosoma mansoni metabotropic glutamate receptor 0.006 0.074 0.0713
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0121 0.2292 0.2292
Onchocerca volvulus 0.0037 0.0153 0.0549
Schistosoma mansoni neuropeptide F-like receptor 0.0037 0.0153 0.0125
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) neuropeptide F receptor 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus granulosus neuropeptide receptor 0.0037 0.0153 0.0125
Echinococcus granulosus cathepsin b 0.0425 1 1
Echinococcus multilocularis neuropeptide Y receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Schistosoma mansoni amine GPCR 0.0037 0.0153 0.0125
Brugia malayi AKH receptor 0.0037 0.0153 0.0139
Schistosoma mansoni neuropeptide receptor 0.0037 0.0153 0.0125
Brugia malayi Papain family cysteine protease containing protein 0.0032 0.0029 0.0015
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Schistosoma mansoni adenoreceptor 0.0037 0.0153 0.0125
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi Melatonin receptor type 1A 0.0037 0.0153 0.0139
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0037 0.0153 0.0125
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0085 0.1374 0.135
Brugia malayi cathepsin F-like cysteine proteinase 0.0032 0.0029 0.0015
Echinococcus granulosus g protein coupled receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis somatostatin receptor 0.0037 0.0153 0.0125
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0425 1 1
Brugia malayi cathepsin L-like cysteine proteinase 0.0032 0.0029 0.0015
Echinococcus granulosus tm gpcr rhodopsin 0.0037 0.0153 0.0125
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0204 0.0176
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0037 0.0153 0.0125
Schistosoma mansoni neuropeptide receptor 0.0037 0.0153 0.0125
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0037 0.0153 0.0125
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Brugia malayi Serotonin receptor 0.0037 0.0153 0.0139
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0037 0.0153 0.0139
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0037 0.0153 0.0125
Trypanosoma cruzi cysteine peptidase, putative 0.0121 0.2292 0.227
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Echinococcus multilocularis serotonin receptor 0.0037 0.0153 0.0125
Schistosoma mansoni hypothetical protein 0.0037 0.0153 0.0125
Schistosoma mansoni amine GPCR 0.0037 0.0153 0.0125
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Echinococcus multilocularis cathepsin L cysteine protease 0.0121 0.2292 0.227
Onchocerca volvulus 0.0037 0.0153 0.0549
Brugia malayi Cathepsin L-like cysteine proteinase 0.0085 0.1374 0.1363
Echinococcus granulosus cathepsin L 0.0068 0.0946 0.092
Schistosoma mansoni hypothetical protein 0.0037 0.0153 0.0125
Plasmodium vivax unspecified product 0.0068 0.0946 0.4054
Schistosoma mansoni cathepsin s 0.0036 0.0126 0.0097
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0068 0.0946 0.2976
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0068 0.0946 0.092
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0037 0.0153 0.0549
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus granulosus neuropeptides capa receptor 0.0037 0.0153 0.0125
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Brugia malayi fibroinase precursor 0.0032 0.0029 0.0015
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0121 0.2292 0.6213
Trypanosoma cruzi cysteine proteinase, putative 0.0068 0.0946 0.092
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0037 0.0153 0.0125
Schistosoma mansoni hypothetical protein 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus granulosus cathepsin l1 0.0121 0.2292 0.227
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0032 0.0029 0.0029
Onchocerca volvulus 0.0037 0.0153 0.0549
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0121 0.2292 0.734
Schistosoma mansoni biogenic amine receptor 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine proteinase, putative 0.0068 0.0946 0.4054
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0154 0.3113 1
Toxoplasma gondii cathepsin B 0.0154 0.3113 1
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0037 0.0153 0.0125
Echinococcus granulosus tachykinin peptides receptor 99D 0.0037 0.0153 0.0125
Brugia malayi Dopamine receptor protein 2 0.0037 0.0153 0.0139
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Echinococcus granulosus somatostatin receptor 0.0037 0.0153 0.0125
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0121 0.2292 0.227
Echinococcus granulosus hypothetical protein 0.0037 0.0153 0.0125
Loa Loa (eye worm) glutamate receptor 0.0049 0.0444 0.0444
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Brugia malayi ORL1-like opioid receptor 0.0037 0.0153 0.0139
Loa Loa (eye worm) hypothetical protein 0.0036 0.0126 0.0126
Brugia malayi hypothetical protein 0.0037 0.0153 0.0139
Entamoeba histolytica cysteine proteinase 2 0.0068 0.0946 0.4054
Brugia malayi Papain family cysteine protease containing protein 0.0121 0.2292 0.2282
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Echinococcus multilocularis neuropeptides capa receptor 0.0037 0.0153 0.0125
Onchocerca volvulus 0.0037 0.0153 0.0549
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0121 0.2292 0.734
Brugia malayi follicle stimulating hormone receptor 0.0037 0.0153 0.0139
Plasmodium falciparum cysteine proteinase falcipain 3 0.0121 0.2292 1
Plasmodium vivax vivapain-3 0.0068 0.0946 0.4054
Onchocerca volvulus 0.0085 0.1374 0.5946
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Giardia lamblia Cathepsin B precursor 0.0154 0.3113 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Onchocerca volvulus 0.0121 0.2292 1
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0037 0.0153 0.0125
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0141 0.2782 0.2761
Echinococcus granulosus neuropeptide receptor A26 0.0037 0.0153 0.0125
Onchocerca volvulus 0.0037 0.0153 0.0549
Onchocerca volvulus 0.0037 0.0153 0.0549
Brugia malayi Papain family cysteine protease containing protein 0.0032 0.0029 0.0015
Onchocerca volvulus 0.0037 0.0153 0.0549
Giardia lamblia Cathepsin B precursor 0.0154 0.3113 1
Onchocerca volvulus 0.0037 0.0153 0.0549
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0068 0.0946 0.092
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0037 0.0153 0.0125
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0121 0.2292 1
Schistosoma mansoni voltage-gated potassium channel 0.0039 0.0204 0.0176
Echinococcus granulosus neuropeptide FF receptor 2 0.0037 0.0153 0.0125
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0037 0.0153 0.0125
Onchocerca volvulus 0.0037 0.0153 0.0549
Brugia malayi Cathepsin L-like precursor 0.0121 0.2292 0.2282
Echinococcus granulosus dro:myosuppressin receptor 0.0037 0.0153 0.0125
Echinococcus granulosus cathepsin L cysteine proteinase 0.0121 0.2292 0.227
Schistosoma mansoni biogenic amine (5HT) receptor 0.0037 0.0153 0.0125
Brugia malayi sulfakinin receptor protein 0.0037 0.0153 0.0139
Loa Loa (eye worm) hypothetical protein 0.0037 0.0153 0.0153
Loa Loa (eye worm) ctsf protein 0.0121 0.2292 0.2292
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0037 0.0153 0.0125
Entamoeba histolytica cysteine protease, putative 0.0068 0.0946 0.4054
Echinococcus multilocularis serotonin receptor 0.0037 0.0153 0.0125
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0037 0.0153 0.0125
Echinococcus granulosus biogenic amine 5HT receptor 0.0037 0.0153 0.0125
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0085 0.1374 0.4364
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0037 0.0153 0.0125
Schistosoma mansoni opsin-like receptor 0.0037 0.0153 0.0125
Brugia malayi neuropeptide F receptor 0.0037 0.0153 0.0139
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0121 0.2292 0.734
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0121 0.2292 0.734
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0068 0.0946 0.092
Brugia malayi putative neuropeptide receptor 0.0037 0.0153 0.0139
Echinococcus multilocularis rhodopsin orphan GPCR 0.0037 0.0153 0.0125
Echinococcus multilocularis cysteine protease 0.0121 0.2292 0.227
Echinococcus granulosus cathepsin b 0.0425 1 1
Brugia malayi GnHR receptor homolog 0.0037 0.0153 0.0139
Brugia malayi cathepsin L precursor 0.0032 0.0029 0.0015
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0032 0.0029 0.0029
Echinococcus multilocularis neuropeptide FF receptor 2 0.0037 0.0153 0.0125

Activities

Activity type Activity value Assay description Source Reference
EC50 (binding) > 112.219 um PUBCHEM_BIOASSAY: Luminescence Biochemical Dose Response HTS to Identify Inhibitors of Luciferase. (Class of assay: confirmatory) [Related pubchem assays: 1663 (Primary HTS), 1678 (Summary of Project)] ChEMBL. No reference
Potency (functional) 3.2944 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 13.1154 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 32.6427 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] 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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