Detailed information for compound 1033095

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 416.921 | Formula: C21H21ClN2O3S
  • H donors: 1 H acceptors: 2 LogP: 4.46 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(ccc1OC)Cc1scc(n1)c1ccc2c(c1)CCC(=O)N2.Cl
  • InChi: 1S/C21H20N2O3S.ClH/c1-25-18-7-3-13(9-19(18)26-2)10-21-23-17(12-27-21)15-4-6-16-14(11-15)5-8-20(24)22-16;/h3-4,6-7,9,11-12H,5,8,10H2,1-2H3,(H,22,24);1H
  • InChiKey: XFBGRNZFYHDDDO-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 DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0273 0.0377 0.037
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0009 0.0002
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0027 0.002 0.0012
Echinococcus multilocularis G protein coupled receptor 139 0.0019 0.0009 0.0002
Schistosoma mansoni sodium/chloride dependent transporter 0.0159 0.0211 0.0204
Brugia malayi hypothetical protein 0.0261 0.0359 0.0359
Echinococcus granulosus biogenic amine 5HT receptor 0.0019 0.0009 0.0002
Leishmania major trypanothione reductase 0.0053 0.0057 0.0059
Brugia malayi ERG2 and Sigma1 receptor like protein 0.5868 0.8495 0.8495
Brugia malayi Thioredoxin reductase 0.0053 0.0057 0.0057
Echinococcus multilocularis g-protein coupled receptor 0.0019 0.0009 0.0002
Brugia malayi Melatonin receptor type 1A 0.0019 0.0009 0.0009
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0019 0.0009 0.0002
Echinococcus granulosus synaptic vesicular amine transporter 0.0192 0.0259 0.0252
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0007 0.0006
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0019 0.0009 0.0002
Brugia malayi follicle stimulating hormone receptor 0.0273 0.0377 0.0377
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0018 0.0007 0.0666
Echinococcus granulosus g protein coupled receptor 0.0019 0.0009 0.0002
Plasmodium vivax glutathione reductase, putative 0.0053 0.0057 1
Echinococcus granulosus alpha 1A adrenergic receptor 0.0019 0.0009 0.0002
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Echinococcus granulosus tachykinin peptides receptor 99D 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0011 0.0011
Loa Loa (eye worm) alpha-L-fucosidase 0.0251 0.0345 0.0337
Schistosoma mansoni amine GPCR 0.0019 0.0009 0.0002
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis neuropeptide receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) neuropeptide F receptor 0.0019 0.0009 0.0001
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0009 0.0002
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0019 0.0009 0.0009
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0027 0.002 0.0012
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0011 0.0011
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) solute carrier family 6 member 4 0.0159 0.0211 0.0204
Loa Loa (eye worm) hypothetical protein 0.2999 0.4332 0.4328
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0019 0.0009 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Brugia malayi RE15519p 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0019 0.0009 0.0002
Trichomonas vaginalis DNA polymerase eta, putative 0.0021 0.0011 0.0117
Trypanosoma cruzi C-8 sterol isomerase, putative 0.5868 0.8495 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0011 0.0004
Echinococcus granulosus allatostatin A receptor 0.0019 0.0009 0.0002
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.0011 0.0004
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0009 0.0002
Leishmania major C-8 sterol isomerase-like protein 0.5868 0.8495 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus neuropeptides capa receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis neuropeptide receptor A26 0.0019 0.0009 0.0002
Echinococcus granulosus serotonin receptor 0.0019 0.0009 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Loa Loa (eye worm) TYRA-2 protein 0.0019 0.0009 0.0001
Toxoplasma gondii exonuclease III APE 0.0021 0.0011 0.1344
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.3011
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi G-protein coupled receptor 0.0019 0.0009 0.0009
Brugia malayi putative neuropeptide receptor 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus neuropeptide receptor 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Echinococcus granulosus tm gpcr rhodopsin 0.0019 0.0009 0.0002
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0011 0.0003
Onchocerca volvulus 0.0034 0.0029 0.002
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.002
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Brugia malayi larval opioid receptor 0.0019 0.0009 0.0009
Echinococcus multilocularis allatostatin A receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis neuropeptide Y receptor 0.0019 0.0009 0.0002
Schistosoma mansoni amine GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis vesicular acetylcholine transporter 0.6906 1 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0011 0.0005
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0135 0.0176 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0029 0.0022
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0019 0.0009 0.0009
Brugia malayi sulfakinin receptor protein 0.0019 0.0009 0.0009
Plasmodium falciparum amino acid transporter, putative 0.0027 0.002 0.2474
Trichomonas vaginalis alpha-L-fucosidase, putative 0.011 0.014 0.3704
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0011 0.0003
Brugia malayi neuropeptide F receptor 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Mycobacterium ulcerans alpha-L-fucosidase 0.0415 0.0583 1
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0019 0.0009 0.0001
Schistosoma mansoni neuropeptide F-like receptor 0.0019 0.0009 0.0002
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0041 0.6877
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0019 0.0009 0.0002
Onchocerca volvulus 0.0027 0.002 0.0011
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.3011
Schistosoma mansoni sodium-dependent amino acid transporter 0.0027 0.002 0.0012
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Echinococcus granulosus beta galactosidase 0.0136 0.0177 0.017
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0121 0.0156 0.8837
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.0011 0.0168
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trichomonas vaginalis DNA helicase recq1, putative 0.0024 0.0015 0.0208
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0011 0.0005
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0021 0.0011 0.0004
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0019 0.0009 0.0002
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0019 0.0009 0.0002
Echinococcus granulosus sex peptide receptor 0.0019 0.0009 0.0002
Brugia malayi GnHR receptor homolog 0.0019 0.0009 0.0009
Giardia lamblia DINP protein human, muc B family 0.0021 0.0011 1
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0021 0.0011 0.0004
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0011 0.0095
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.0011 0.0203
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0254 0.0349 0.0342
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0019 0.0009 0.0001
Trichomonas vaginalis DNA helicase recq, putative 0.0024 0.0015 0.0208
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0053 0.0057 0.2985
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.002
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Plasmodium vivax thioredoxin reductase, putative 0.0053 0.0057 1
Echinococcus granulosus 7TM GPCR rhodopsin 0.0019 0.0009 0.0002
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0019 0.0009 0.0002
Echinococcus granulosus g protein coupled receptor 0.0019 0.0009 0.0002
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0041 0.0041 0.6654
Schistosoma mansoni opsin-like receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0019 0.0009 0.0002
Schistosoma mansoni DNA polymerase eta 0.0021 0.0011 0.0004
Echinococcus granulosus neuropeptide receptor 0.0019 0.0009 0.0002
Trypanosoma brucei trypanothione reductase 0.0053 0.0057 0.0066
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0027 0.002 0.0012
Onchocerca volvulus 0.0027 0.002 0.0011
Brugia malayi G protein-coupled receptor F59B2.13 0.0019 0.0009 0.0009
Leishmania major C-14 sterol reductase, putative 0.0092 0.0113 0.0125
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni neuropeptide f receptor 76f 0.0019 0.0009 0.0002
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Brugia malayi Serotonin receptor 0.0019 0.0009 0.0009
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0019 0.0009 0.0002
Echinococcus multilocularis neuropeptides capa receptor 0.0019 0.0009 0.0002
Brugia malayi Tachykinin-like peptides receptor 99D 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0034 0.0029 0.0021
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trypanosoma cruzi sterol C-24 reductase, putative 0.0048 0.005 0.005
Schistosoma mansoni neuropeptide receptor 0.0019 0.0009 0.0002
Schistosoma mansoni neuropeptide F-like receptor 0.0019 0.0009 0.0002
Schistosoma mansoni alpha-1 adrenergic receptor 0.0019 0.0009 0.0002
Schistosoma mansoni neuropeptide receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis sex peptide receptor 0.0019 0.0009 0.0002
Echinococcus granulosus G protein coupled receptor 139 0.0019 0.0009 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0019 0.0009 0.0002
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0027 0.002 0.0012
Schistosoma mansoni neuropeptide receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0018 0.0007 0.0666
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0027 0.002 0.002
Schistosoma mansoni biogenic amine receptor 0.0019 0.0009 0.0002
Mycobacterium tuberculosis Probable dehydrogenase 0.0121 0.0156 0.8837
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0011 0.0679
Mycobacterium tuberculosis Conserved hypothetical protein 0.0021 0.0011 0.0249
Echinococcus multilocularis beta galactosidase 0.0136 0.0177 0.017
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Schistosoma mansoni amine GPCR 0.0019 0.0009 0.0002
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0011 0.0073
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Onchocerca volvulus Glucosylceramidase homolog 0.0167 0.0222 0.0214
Echinococcus granulosus dro:myosuppressin receptor 0.0019 0.0009 0.0002
Schistosoma mansoni opsin-like receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) neuropeptide F receptor 0.0019 0.0009 0.0001
Echinococcus multilocularis neuropeptides capa receptor 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0261 0.0359 0.0352
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.0011 0.0059
Echinococcus granulosus neuropeptide receptor A26 0.0019 0.0009 0.0002
Echinococcus granulosus g-protein coupled receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0029 0.0022
Loa Loa (eye worm) hypothetical protein 0.5868 0.8495 0.8494
Loa Loa (eye worm) G-protein coupled receptor 0.0019 0.0009 0.0001
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0019 0.0009 0.0002
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis dna polymerase kappa 0.0021 0.0011 0.0004
Loa Loa (eye worm) hypothetical protein 0.0159 0.0211 0.0204
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0018 0.0007 0.0006
Leishmania major DNA polymerase eta, putative 0.0021 0.0011 0.0005
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0053 0.0058 0.0058
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0136 0.0177 0.017
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.0012
Trypanosoma brucei C-8 sterol isomerase, putative 0.5868 0.8495 1
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0021 0.0011 0.0117
Echinococcus multilocularis fucosidase, alpha L 1, tissue 0.0415 0.0583 0.0576
Echinococcus multilocularis thioredoxin glutathione reductase 0.0053 0.0057 0.005
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0029 0.4761
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Echinococcus granulosus 7tm_1 domain containing protein 0.0019 0.0009 0.0002
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.0011 0.001
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus biogenic amine 5HT receptor 0.0019 0.0009 0.0002
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis sodium and chloride dependent glycine 0.0027 0.002 0.0012
Schistosoma mansoni survival motor neuron protein 0.0053 0.0058 0.0051
Schistosoma mansoni hypothetical protein 0.0377 0.0528 0.0521
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0121 0.0156 0.8837
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0011 0.0095
Echinococcus multilocularis synaptic vesicular amine transporter 0.0192 0.0259 0.0252
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni biogenic amine (5HT) receptor 0.0019 0.0009 0.0002
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0254 0.0349 0.0349
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0027 0.002 0.0012
Echinococcus granulosus serotonin transporter 0.0159 0.0211 0.0204
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0019 0.0009 0.0002
Schistosoma mansoni hypothetical protein 0.0019 0.0009 0.0002
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0027 0.002 0.0012
Echinococcus granulosus neuropeptide FF receptor 2 0.0019 0.0009 0.0002
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0011 0.0011
Echinococcus granulosus vesicular acetylcholine transporter 0.6906 1 1
Brugia malayi Dopamine receptor protein 1 0.0019 0.0009 0.0009
Trypanosoma cruzi C-14 sterol reductase, putative 0.0092 0.0113 0.0125
Brugia malayi Dopamine receptor 0.0019 0.0009 0.0009
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Brugia malayi glutathione reductase 0.0053 0.0057 0.0057
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0018 0.0007 0.0007
Loa Loa (eye worm) abnormal catecholamine distribution protein 1 0.0192 0.0259 0.0252
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0011 0.0005
Echinococcus granulosus tm gpcr rhodopsin 0.111 0.1592 0.1586
Brugia malayi G-protein coupled receptor 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0029 0.0022
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Schistosoma mansoni growth hormone secretagogue receptor 0.0019 0.0009 0.0002
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Schistosoma mansoni myosin xvIII 0.0019 0.0009 0.0002
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis lamin b receptor 0.0092 0.0113 0.0106
Echinococcus granulosus dna polymerase eta 0.0021 0.0011 0.0004
Brugia malayi hypothetical protein 0.0027 0.002 0.002
Echinococcus multilocularis geminin 0.0377 0.0528 0.0521
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0021 0.0011 0.0005
Echinococcus granulosus geminin 0.0377 0.0528 0.0521
Brugia malayi Serotonin receptor 0.0019 0.0009 0.0009
Echinococcus multilocularis neuropeptide s receptor 0.0019 0.0009 0.0002
Schistosoma mansoni sodium/chloride dependent transporter 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Brugia malayi putative neuropeptide receptor NPR1 0.0019 0.0009 0.0009
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi Bloom's syndrome protein homolog 0.0024 0.0015 0.0015
Brugia malayi Pre-SET motif family protein 0.0234 0.0319 0.0319
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0159 0.0211 0.0204
Plasmodium vivax hypothetical protein, conserved 0.0027 0.002 0.2976
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0234 0.0319 0.0312
Onchocerca volvulus 0.0027 0.002 0.0011
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi G protein-coupled receptor 0.0019 0.0009 0.0009
Loa Loa (eye worm) serotonin transporter b 0.0159 0.0211 0.0204
Echinococcus multilocularis sodium and chloride dependent glycine 0.0027 0.002 0.0012
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0021 0.0011 0.0004
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0029 0.0022
Schistosoma mansoni sodium/chloride dependent transporter 0.0027 0.002 0.0012
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Echinococcus granulosus g protein coupled receptor 0.0019 0.0009 0.0002
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.0011 0.0004
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus sodium and chloride dependent glycine 0.0027 0.002 0.0012
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.0011 0.0004
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Brugia malayi Pre-SET motif family protein 0.0034 0.0029 0.0029
Echinococcus granulosus tm gpcr rhodopsin 0.0019 0.0009 0.0002
Trichomonas vaginalis alpha-L-fucosidase, putative 0.011 0.014 0.3704
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus neuropeptide Y receptor 0.0019 0.0009 0.0002
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni hypothetical protein 0.0053 0.0058 0.0051
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Loa Loa (eye worm) melatonin receptor type 1A 0.0019 0.0009 0.0001
Echinococcus multilocularis g protein coupled receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0019 0.0009 0.0002
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus sodium and chloride dependent glycine 0.0027 0.002 0.0012
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0135 0.0176 1
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0019 0.0009 0.0009
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.0012
Echinococcus multilocularis serotonin receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) G-protein coupled receptor 0.0019 0.0009 0.0001
Brugia malayi Alpha-L-fucosidase family protein 0.0251 0.0345 0.0345
Loa Loa (eye worm) hypothetical protein 0.0159 0.0211 0.0204
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0018 0.0007 0.0714
Leishmania major sterol C-24 reductase, putative 0.0048 0.005 0.005
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0019 0.0009 0.0002
Schistosoma mansoni neuropeptide receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0019 0.0009 0.0002
Schistosoma mansoni hypothetical protein 0.0019 0.0009 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Schistosoma mansoni Lamin B receptor (ERG24) 0.0092 0.0113 0.0106
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0029 0.0022
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0236 0.6359
Schistosoma mansoni terminal deoxycytidyl transferase 0.0021 0.0011 0.0004
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0011 0.13
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus somatostatin receptor 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0011 0.0011
Echinococcus multilocularis somatostatin receptor 0.0019 0.0009 0.0002
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0027 0.002 0.0012
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.6906 1 1
Echinococcus multilocularis survival motor neuron protein 1 0.0261 0.0359 0.0352
Schistosoma mansoni hypothetical protein 0.0019 0.0009 0.0002
Loa Loa (eye worm) thioredoxin reductase 0.0053 0.0057 0.005
Schistosoma mansoni alpha-l-fucosidase 0.0251 0.0345 0.0338
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.111 0.1592 0.1586
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0029 0.0022
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0018 0.0007 0.0006
Toxoplasma gondii hypothetical protein 0.0027 0.002 0.3011
Schistosoma mansoni ap endonuclease 0.0021 0.0011 0.0003
Schistosoma mansoni adenoreceptor 0.0019 0.0009 0.0002
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Trichomonas vaginalis set domain proteins, putative 0.0266 0.0366 1
Trypanosoma cruzi C-14 sterol reductase, putative 0.0092 0.0113 0.0125
Trypanosoma brucei unspecified product 0.0021 0.0011 0.0011
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0159 0.0211 0.0211
Echinococcus granulosus orexin receptor type 2 0.0019 0.0009 0.0002
Echinococcus multilocularis dro:myosuppressin receptor 0.0019 0.0009 0.0002
Toxoplasma gondii NADPH-glutathione reductase 0.0018 0.0007 0.0714
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0019 0.0009 0.0002
Plasmodium vivax amine transporter, putative 0.0027 0.002 0.2976
Mycobacterium ulcerans DNA polymerase IV 0.0021 0.0011 0.0073
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0027 0.002 0.0012
Echinococcus granulosus fucosidase alpha L 1 tissue 0.0415 0.0583 0.0576
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.0011 0.8127
Echinococcus granulosus dna polymerase kappa 0.0021 0.0011 0.0004
Trypanosoma brucei DNA polymerase IV, putative 0.0021 0.0011 0.0011
Echinococcus granulosus neuropeptides capa receptor 0.0019 0.0009 0.0002
Echinococcus granulosus rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis dna polymerase eta 0.0021 0.0011 0.0004
Mycobacterium tuberculosis Probable oxidoreductase 0.0135 0.0176 1
Trypanosoma brucei C-14 sterol reductase, putative 0.0092 0.0113 0.0132
Trichomonas vaginalis glucosylceramidase, putative 0.0167 0.0222 0.5996
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0029 0.0022
Echinococcus multilocularis bloom syndrome protein 0.0024 0.0015 0.0007
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Schistosoma mansoni ap endonuclease 0.0021 0.0011 0.0003
Treponema pallidum sodium- and chloride- dependent transporter 0.0159 0.0211 1
Echinococcus multilocularis neuropeptide receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0019 0.0009 0.0009
Trypanosoma cruzi sterol C-24 reductase, putative 0.0048 0.005 0.005
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0019 0.0009 0.0002
Brugia malayi Dopamine receptor protein 2 0.0019 0.0009 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Toxoplasma gondii hypothetical protein 0.0027 0.002 0.3011
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0135 0.0176 1
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0018 0.0007 0.0006
Loa Loa (eye worm) hypothetical protein 0.0136 0.0177 0.017
Echinococcus multilocularis fmrfamide receptor 0.0019 0.0009 0.0002
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0027 0.002
Echinococcus multilocularis serotonin transporter 0.0159 0.0211 0.0204
Entamoeba histolytica deoxycytidyl transferase, putative 0.0021 0.0011 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.3011
Plasmodium falciparum thioredoxin reductase 0.0053 0.0057 1
Schistosoma mansoni hypothetical protein 0.0377 0.0528 0.0521
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0027 0.002 0.0012
Echinococcus multilocularis serotonin receptor 0.0019 0.0009 0.0002
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.0011 1
Echinococcus granulosus neuropeptide s receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0048 0.005 0.0042
Brugia malayi ImpB/MucB/SamB family protein 0.0021 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0027 0.002 0.0012
Schistosoma mansoni vesicular amine transporter 0.0192 0.0259 0.0252
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Toxoplasma gondii thioredoxin reductase 0.0053 0.0057 1
Loa Loa (eye worm) norepinephrine transporter 0.0159 0.0211 0.0204
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Trypanosoma cruzi trypanothione reductase, putative 0.0053 0.0057 0.0059
Mycobacterium tuberculosis Probable reductase 0.0121 0.0156 0.8837
Plasmodium falciparum transporter, putative 0.0027 0.002 0.2474
Onchocerca volvulus 0.0053 0.0058 0.0049
Schistosoma mansoni amine GPCR 0.0019 0.0009 0.0002
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0027 0.002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Plasmodium falciparum glutathione reductase 0.0053 0.0057 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0159 0.0211 0.0204
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Schistosoma mansoni biogenic amine receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0027 0.002 0.0012
Trichomonas vaginalis glucosylceramidase, putative 0.0254 0.0349 0.9528
Echinococcus granulosus thioredoxin glutathione reductase 0.0053 0.0057 0.005
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0027 0.002 0.002
Echinococcus granulosus fmrfamide receptor 0.0019 0.0009 0.0002
Echinococcus granulosus peptide allatostatin:somatostatin 0.0019 0.0009 0.0002
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0011 0.0003
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0019 0.0009 0.0002
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.6906 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0019 0.0009 0.0002
Brugia malayi AKH receptor 0.0019 0.0009 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0021 0.0011 0.0249
Schistosoma mansoni histamine h1 receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis neuropeptide FF receptor 2 0.0019 0.0009 0.0002
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase eta, putative 0.0021 0.0011 0.0011
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0027 0.002 1
Leishmania major DNA polymerase kappa, putative 0.0021 0.0011 0.0005
Echinococcus multilocularis fmrfamide receptor 0.0019 0.0009 0.0002
Plasmodium vivax SET domain protein, putative 0.0034 0.0029 0.4734
Schistosoma mansoni hypothetical protein 0.0019 0.0009 0.0002
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0019 0.0009 0.0002
Schistosoma mansoni amine GPCR 0.0019 0.0009 0.0002
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0019 0.0009 0.0002
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0121 0.0156 0.8837
Echinococcus granulosus neuropeptide Y receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0019 0.0009 0.0001
Brugia malayi ORL1-like opioid receptor 0.0019 0.0009 0.0009
Schistosoma mansoni beta-galactosidase 0.0136 0.0177 0.017
Echinococcus multilocularis G-protein coupled receptor, putative 0.0019 0.0009 0.0002
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Echinococcus granulosus lamin b receptor 0.0092 0.0113 0.0106
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0021 0.0011 0.0004
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0121 0.0156 0.8837
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0019 0.0009 0.0002
Schistosoma mansoni opsin-like receptor 0.0019 0.0009 0.0002
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0027 0.002 0.0012
Brugia malayi Abnormal catecholamine distribution protein 1 0.0192 0.0259 0.0259
Onchocerca volvulus 0.0266 0.0366 0.0358
Echinococcus multilocularis neuropeptide Y receptor 0.0019 0.0009 0.0002
Loa Loa (eye worm) glutathione reductase 0.0053 0.0057 0.005
Brugia malayi hypothetical protein 0.0019 0.0009 0.0009
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0019 0.0009 0.0001
Echinococcus granulosus survival motor neuron protein 1 0.0261 0.0359 0.0352
Loa Loa (eye worm) RecQ helicase 0.0024 0.0015 0.0007
Brugia malayi neuropeptide F receptor 0.0019 0.0009 0.0009
Schistosoma mansoni biogenic amine receptor 0.0019 0.0009 0.0002
Echinococcus granulosus bloom syndrome protein 0.0024 0.0015 0.0007
Trypanosoma cruzi DNA polymerase eta, putative 0.0021 0.0011 0.0005
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0021 0.001 0.066
Schistosoma mansoni vesicular acetylcholine transporter 0.6906 1 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Echinococcus granulosus hypothetical protein 0.0019 0.0009 0.0002
Loa Loa (eye worm) hypothetical protein 0.0019 0.0009 0.0001
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0019 0.0009 0.0009
Onchocerca volvulus 0.0159 0.0211 0.0203
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0019 0.0009 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.0236 0.6359
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0027 0.002 0.0012
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0011 0.0011
Echinococcus multilocularis rhodopsin orphan GPCR 0.0019 0.0009 0.0002
Echinococcus multilocularis orexin receptor type 2 0.0019 0.0009 0.0002
Trypanosoma cruzi DNA polymerase kappa, putative 0.0021 0.0011 0.0005

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 10 uM In vitro inhibitory activity against superoxide production from human neutrophils stimulated with f-MLP ChEMBL. 7830278

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 7830278

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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