Detailed information for compound 348118

Basic information

Technical information
  • TDR Targets ID: 348118
  • Name: N-[bis(3,4-dichlorophenyl)methyl]-8-methyl-8- azabicyclo[3.2.1]octan-3-amine
  • MW: 444.225 | Formula: C21H22Cl4N2
  • H donors: 1 H acceptors: 0 LogP: 6.71 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1C2CCC1CC(C2)NC(c1ccc(c(c1)Cl)Cl)c1ccc(c(c1)Cl)Cl
  • InChi: 1S/C21H22Cl4N2/c1-27-15-4-5-16(27)11-14(10-15)26-21(12-2-6-17(22)19(24)8-12)13-3-7-18(23)20(25)9-13/h2-3,6-9,14-16,21,26H,4-5,10-11H2,1H3
  • InChiKey: OJNGNVWCSYYTTM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • bis(3,4-dichlorophenyl)methyl-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amine

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
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0034 0.0375 0.084
Entamoeba histolytica Ran family GTPase 0.0021 0.0215 0.8795
Mycobacterium ulcerans beta-lactamase 0.0036 0.0404 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.8975
Schistosoma mansoni importin-beta 2 0.0005 0.0013 0.0015
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0034 0.004
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0034 0.0375 0.9274
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.8975
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0688 0.8708 1
Echinococcus multilocularis nuclear receptor nhr 48 0.0324 0.4078 0.4078
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Brugia malayi Steroid receptor seven-up type 2 0.0688 0.8708 1
Brugia malayi orphan nuclear receptor NR2E1 0.0324 0.4078 0.4683
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0688 0.8708 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0404 1
Schistosoma mansoni cpg binding protein 0.0029 0.0311 0.0357
Mycobacterium tuberculosis Conserved protein 0.0036 0.0404 0.0943
Onchocerca volvulus 0.0029 0.0311 0.0357
Onchocerca volvulus 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0404 0.0943
Plasmodium falciparum transporter, putative 0.005 0.0575 1
Echinococcus granulosus ecdysone induced protein 78C 0.0688 0.8708 1
Echinococcus granulosus importin 5 0.0005 0.0013 0.0015
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0145 0.0167
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0034 0.0375 0.084
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0404 0.0943
Onchocerca volvulus 0.0324 0.4078 0.4683
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0034 0.0375 0.8902
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Echinococcus multilocularis 0.0034 0.0375 0.0375
Brugia malayi hypothetical protein 0.0324 0.4078 0.4683
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0688 0.8708 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.8975
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0324 0.4078 0.4078
Brugia malayi hypothetical protein 0.005 0.0575 0.066
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.066
Brugia malayi beta-lactamase family protein 0.0036 0.0404 0.0464
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0688 0.8708 1
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0034 0.0375 0.084
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0404 0.0464
Schistosoma mansoni cytochrome P450 0.0034 0.0375 0.0431
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0145 0.0167
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0688 0.8708 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Brugia malayi hypothetical protein 0.0363 0.4574 0.5252
Brugia malayi conserved hypotetical protein 0.0324 0.4078 0.4683
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.005 0.0575 0.0575
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0034 0.0375 0.8902
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0404 0.0943
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0215 0.2684
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Brugia malayi cytochrome P450 0.0034 0.0375 0.0431
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0324 0.4078 0.4683
Loa Loa (eye worm) DR-78 0.0324 0.4078 0.4683
Brugia malayi nuclear hormone receptor 0.0324 0.4078 0.4683
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0034 0.0375 0.8902
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0363 0.4574 0.5252
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0688 0.8708 1
Brugia malayi Cytochrome P450 family protein 0.0034 0.0375 0.0431
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0363 0.4574 0.5252
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0242 0.3753
Loa Loa (eye worm) hypothetical protein 0.0363 0.4574 0.5252
Leishmania major cytochrome p450-like protein 0.0034 0.0375 0.9274
Trichomonas vaginalis ran, putative 0.0021 0.0215 0.5161
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0688 0.8708 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0688 0.8708 1
Brugia malayi nuclear receptor RXR 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0404 0.0943
Loa Loa (eye worm) nuclear hormone receptor 0.0324 0.4078 0.4683
Mycobacterium ulcerans lipase LipD 0.0036 0.0404 1
Echinococcus granulosus sodium and chloride dependent glycine 0.005 0.0575 0.066
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0688 0.8708 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.0639 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0145 0.3386
Toxoplasma gondii HEAT repeat-containing protein 0.0029 0.0312 0.4776
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0688 0.8708 1
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.005 0.0575 0.066
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Trichomonas vaginalis helicase, putative 0.0007 0.0026 0.0345
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0324 0.4078 0.4683
Schistosoma mansoni hypothetical protein 0.017 0.2111 0.2424
Echinococcus granulosus uncharacterized sodium dependent transporter 0.005 0.0575 0.066
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0034 0.0375 0.084
Echinococcus granulosus sodium and chloride dependent glycine 0.005 0.0575 0.066
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.066
Brugia malayi Nuclear hormone receptor-like 1 0.0363 0.4574 0.5252
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0688 0.8708 1
Onchocerca volvulus 0.0036 0.0404 0.0464
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.005 0.0575 0.5
Brugia malayi nuclear receptor NHR-88 0.0324 0.4078 0.4683
Onchocerca volvulus Protein ultraspiracle homolog 0.0688 0.8708 1
Schistosoma mansoni sodium/chloride dependent transporter 0.005 0.0575 0.066
Schistosoma mansoni cpg binding protein 0.003 0.0332 0.0381
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0688 0.8708 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.066
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0034 0.0034
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0034 0.0375 0.084
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0235 0.2943 0.3379
Onchocerca volvulus 0.005 0.0575 0.066
Brugia malayi Nuclear hormone receptor-like 1 0.0363 0.4574 0.5252
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Schistosoma mansoni thyroid hormone receptor 0.0688 0.8708 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0292 0.3666 0.4209
Brugia malayi nuclear hormone receptor 0.0688 0.8708 1
Loa Loa (eye worm) beta-lactamase 0.0036 0.0404 0.0464
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0034 0.0034
Brugia malayi follicle stimulating hormone receptor 0.0235 0.2943 0.3379
Echinococcus multilocularis serotonin transporter 0.0292 0.3666 0.3666
Toxoplasma gondii ABC1 family protein 0.0036 0.0404 0.624
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0034 0.0375 0.084
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0324 0.4078 0.4683
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0324 0.4078 0.4683
Schistosoma mansoni nuclear receptor 0.0324 0.4078 0.4683
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0311 0.0357
Schistosoma mansoni importin beta-1 0.0029 0.0312 0.0358
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.005 0.0575 0.0575
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0034 0.0375 0.9274
Schistosoma mansoni hypothetical protein 0.017 0.2111 0.2424
Mycobacterium leprae Probable lipase LipE 0.0036 0.0404 1
Echinococcus multilocularis snurportin 1 0.0309 0.3881 0.3881
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Loa Loa (eye worm) hypothetical protein 0.0363 0.4574 0.5252
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.005 0.0575 0.066
Leishmania major hypothetical protein, conserved 0.0036 0.0404 1
Treponema pallidum sodium- and chloride- dependent transporter 0.0292 0.3666 0.5
Plasmodium falciparum importin beta, putative 0.0029 0.0312 0.5321
Brugia malayi hypothetical protein 0.0363 0.4574 0.5252
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0034 0.0375 0.084
Schistosoma mansoni nuclear hormone receptor 0.0324 0.4078 0.4683
Loa Loa (eye worm) steroid hormone receptor 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Brugia malayi nuclear receptor NHR-67 0.0324 0.4078 0.4683
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0688 0.8708 0.8708
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0145 0.3386
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.005 0.0575 0.066
Brugia malayi ecdysteroid receptor 0.0688 0.8708 1
Mycobacterium tuberculosis Conserved protein 0.0036 0.0404 0.0943
Schistosoma mansoni nuclear receptor 0.0324 0.4078 0.4683
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0057 0.0065
Trypanosoma cruzi cytochrome P450, putative 0.0034 0.0375 0.8902
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0324 0.4078 0.4683
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0404 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0688 0.8708 0.8708
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0057 0.0065
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0404 0.0464
Loa Loa (eye worm) hypothetical protein 0.0363 0.4574 0.5252
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0404 1
Echinococcus granulosus translational activator gcn1 0.0005 0.0013 0.0015
Brugia malayi Cytochrome P450 family protein 0.0034 0.0375 0.0431
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0688 0.8708 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0312 0.7653
Echinococcus granulosus importin subunit beta 1 0.0029 0.0312 0.0358
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0145 0.0145
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0688 0.8708 1
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0021 0.0215 0.3589
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0404 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0324 0.4078 0.4078
Schistosoma mansoni steroid hormone receptor ad4bp 0.0688 0.8708 1
Echinococcus multilocularis sodium and chloride dependent glycine 0.005 0.0575 0.0575
Echinococcus multilocularis sodium and chloride dependent glycine 0.005 0.0575 0.0575
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0688 0.8708 1
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0145 0.2113
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0688 0.8708 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0034 0.0375 0.0431
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0215 0.0246
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0021 0.0215 0.2684
Echinococcus multilocularis geminin 0.017 0.2111 0.2111
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Brugia malayi nuclear receptor RXR 0.0363 0.4574 0.5252
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0688 0.8708 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Toxoplasma gondii hypothetical protein 0.005 0.0575 0.8975
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0034 0.004
Loa Loa (eye worm) serotonin transporter b 0.0292 0.3666 0.4209
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0363 0.4574 0.5252
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0242 0.5868
Mycobacterium tuberculosis Conserved protein 0.0036 0.0404 0.0943
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0292 0.3666 0.4209
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0231 0.2886 1
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0034 0.0375 0.084
Leishmania major importin beta-1 subunit, putative 0.0023 0.0242 0.5868
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.005 0.0575 0.066
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0688 0.8708 1
Schistosoma mansoni coup transcription factor 0.0688 0.8708 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Leishmania major cytochrome p450-like protein 0.0034 0.0375 0.9274
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0688 0.8708 0.8708
Brugia malayi hypothetical protein 0.0324 0.4078 0.4683
Brugia malayi kap beta 3 protein 0.0005 0.0013 0.0015
Echinococcus granulosus cytochrome P450 2K1 0.0034 0.0375 0.0431
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Toxoplasma gondii hypothetical protein 0.005 0.0575 0.8975
Echinococcus granulosus geminin 0.017 0.2111 0.2424
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Echinococcus granulosus nuclear receptor nhr 48 0.0324 0.4078 0.4683
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0688 0.8708 1
Brugia malayi nuclear hormone receptor family member odr-7 0.0324 0.4078 0.4683
Schistosoma mansoni hypothetical protein 0.0309 0.3881 0.4457
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0145 0.0145
Mycobacterium ulcerans hypothetical protein 0.0036 0.0404 1
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0055 0.0064
Echinococcus granulosus cpg binding protein 0.003 0.0332 0.0381
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0034 0.0375 0.084
Onchocerca volvulus 0.0036 0.0404 0.0464
Echinococcus multilocularis cpg binding protein 0.003 0.0332 0.0332
Loa Loa (eye worm) hypothetical protein 0.0292 0.3666 0.4209
Brugia malayi steroid hormone receptor 0.0688 0.8708 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.066
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0404 1
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0145 0.0145
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0215 0.0246
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0688 0.8708 1
Echinococcus granulosus Nuclear hormone receptor HR96 0.0324 0.4078 0.4683
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0034 0.0375 0.084
Loa Loa (eye worm) hypothetical protein 0.0029 0.0312 0.0358
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0034 0.004
Onchocerca volvulus 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0324 0.4078 0.4078
Trypanosoma cruzi cytochrome P450, putative 0.0034 0.0375 0.8902
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0242 0.5868
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0215 0.0246
Echinococcus granulosus thyroid hormone receptor alpha 0.0324 0.4078 0.4683
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0404 0.0404
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0034 0.0375 0.084
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0242 0.5868
Schistosoma mansoni hypothetical protein 0.0034 0.0375 0.0431
Brugia malayi Nuclear hormone receptor-like 1 0.0688 0.8708 1
Schistosoma mansoni nuclear receptor nhr-48 0.0324 0.4078 0.4683
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.005 0.0575 0.066
Schistosoma mansoni thyroid hormone receptor 0.0688 0.8708 1
Brugia malayi Nuclear hormone receptor E75 0.0324 0.4078 0.4683
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0404 0.0464
Echinococcus granulosus Nuclear hormone receptor HR96 0.0324 0.4078 0.4683
Onchocerca volvulus 0.005 0.0575 0.066
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0324 0.4078 0.4078
Onchocerca volvulus 0.0292 0.3666 0.4209
Schistosoma mansoni cpg binding protein 0.003 0.0332 0.0381
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0145 0.0145
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0404 1
Brugia malayi Nuclear hormone receptor E75 0.0324 0.4078 0.4683
Echinococcus granulosus snurportin 1 0.0309 0.3881 0.4457
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0404 0.0464
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0688 0.8708 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0034 0.0375 0.0431
Schistosoma mansoni ran 0.0021 0.0215 0.0246
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0026 0.0345
Plasmodium vivax amine transporter, putative 0.005 0.0575 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0688 0.8708 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0292 0.3666 0.4209
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0688 0.8708 1
Onchocerca volvulus 0.005 0.0575 0.066
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.005 0.0575 0.066
Loa Loa (eye worm) solute carrier family 6 member 4 0.0292 0.3666 0.4209
Trypanosoma brucei cytochrome P450, putative 0.0034 0.0375 0.9274
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0404 0.0943
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0688 0.8708 0.8708
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0145 0.0145
Schistosoma mansoni nuclear hormone receptor 0.0688 0.8708 1
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0034 0.0375 0.084
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0688 0.8708 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0034 0.0375 0.0431
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0061 0.0722 0.083
Echinococcus multilocularis importin 5 0.0005 0.0013 0.0013
Echinococcus multilocularis thyroid hormone receptor alpha 0.0688 0.8708 0.8708
Loa Loa (eye worm) hypothetical protein 0.0363 0.4574 0.5252
Loa Loa (eye worm) importin-beta domain-containing protein 0.0005 0.0013 0.0015
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0215 0.0215
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0404 0.0943
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.005 0.0575 0.066
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0688 0.8708 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0292 0.3666 0.4209
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0021 0.0215 0.5161
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0034 0.0375 0.084
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.0404 1
Brugia malayi Importin beta-1 subunit 0.0029 0.0312 0.0358
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0021 0.0215 0.3221
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0688 0.8708 1
Plasmodium vivax hypothetical protein, conserved 0.005 0.0575 1
Echinococcus granulosus FTZ F1 alpha 0.0688 0.8708 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.005 0.0575 0.066
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0145 0.2354
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Brugia malayi RNA, U transporter 1 0.0082 0.0992 0.1139
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0404 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0404 0.0464
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0404 1
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0021 0.0215 0.3589
Leishmania major cytochrome p450-like protein 0.0034 0.0375 0.9274
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0324 0.4078 0.4683
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0145 0.2113
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0324 0.4078 0.4683
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Echinococcus multilocularis importin subunit beta 1 0.0029 0.0312 0.0312
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0324 0.4078 0.4683
Schistosoma mansoni sodium/chloride dependent transporter 0.005 0.0575 0.066
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.005 0.0575 0.066
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Onchocerca volvulus Bile acid receptor homolog 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.005 0.0575 0.0575
Brugia malayi nuclear hormone receptor family member nhr-6 0.0324 0.4078 0.4683
Toxoplasma gondii cytochrome p450 superfamily protein 0.0034 0.0375 0.5787
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0363 0.4574 0.4574
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0688 0.8708 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0688 0.8708 0.8708
Loa Loa (eye worm) kap beta 3 protein 0.0005 0.0013 0.0015
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0404 0.6953
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0034 0.0375 0.084
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0404 0.0943
Brugia malayi beta-lactamase 0.0036 0.0404 0.0464
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Schistosoma mansoni zinc finger protein 0.0324 0.4078 0.4683
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0363 0.4574 0.5252
Echinococcus multilocularis FTZ F1 alpha 0.0688 0.8708 0.8708
Schistosoma mansoni RAR-like nuclear receptor 0.0688 0.8708 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0404 0.0464
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0145 0.0167
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0.0145 0.2354
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0309 0.3881 0.4457
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Loa Loa (eye worm) CYP4Cod1 0.0034 0.0375 0.0431
Loa Loa (eye worm) cytochrome P450 0.0034 0.0375 0.0431
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.005 0.0575 0.066
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0034 0.0375 0.084
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.005 0.0575 0.066
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0034 0.0375 0.084
Brugia malayi tailless protein 0.0324 0.4078 0.4683
Loa Loa (eye worm) hypothetical protein 0.0688 0.8708 1
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0215 0.5
Loa Loa (eye worm) norepinephrine transporter 0.0292 0.3666 0.4209
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0292 0.3666 0.4209
Plasmodium vivax importin-beta 2, putative 0.0029 0.0312 0.5321
Echinococcus granulosus uncharacterized sodium dependent transporter 0.005 0.0575 0.066
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0034 0.0375 0.084
Echinococcus multilocularis translational activator gcn1 0.0005 0.0013 0.0013
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0404 1
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0034 0.0375 0.084
Echinococcus granulosus serotonin transporter 0.0292 0.3666 0.4209
Brugia malayi beta-lactamase family protein 0.0036 0.0404 0.0464
Brugia malayi CXXC zinc finger family protein 0.0029 0.0311 0.0357
Echinococcus multilocularis transportin 1 0.0005 0.0013 0.0013
Schistosoma mansoni ran 0.0021 0.0215 0.0246
Onchocerca volvulus 0.0036 0.0404 0.0464
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0026 0.0345
Brugia malayi photoreceptor-specific nuclear receptor 0.0688 0.8708 1
Entamoeba histolytica hypothetical protein 0.0023 0.0242 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0026 0.0345
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0034 0.0375 0.084
Brugia malayi Cytochrome P450 family protein 0.0034 0.0375 0.0431
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0688 0.8708 0.8708
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0688 0.8708 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0312 0.7653
Plasmodium falciparum amino acid transporter, putative 0.005 0.0575 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0688 0.8708 1
Brugia malayi ecdysone receptor 0.0324 0.4078 0.4683
Brugia malayi nuclear receptor NHR-88 0.0688 0.8708 1
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0324 0.4078 0.4078
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0034 0.0375 0.084
Loa Loa (eye worm) hypothetical protein 0.0324 0.4078 0.4683
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.005 0.0575 0.066
Schistosoma mansoni nuclear hormone receptor 0.0324 0.4078 0.4683
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0688 0.8708 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0688 0.8708 1
Trichomonas vaginalis esterase, putative 0.0036 0.0404 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0145 0.0167
Brugia malayi isocitrate dehydrogenase 0.0016 0.0145 0.0167
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0026 0.0345
Brugia malayi Cytochrome P450 family protein 0.0034 0.0375 0.0431
Leishmania major GTP-binding protein, putative 0.0021 0.0215 0.5161
Loa Loa (eye worm) hypothetical protein 0.0363 0.4574 0.5252
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.0404 1
Schistosoma mansoni retinoic acid receptor RXR 0.0688 0.8708 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0145 0.3386
Echinococcus granulosus transportin 1 0.0005 0.0013 0.0015
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0688 0.8708 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0688 0.8708 0.8708
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0057 0.0057
Loa Loa (eye worm) hypothetical protein 0.005 0.0575 0.066
Loa Loa (eye worm) nuclear receptor NHR-67 0.0324 0.4078 0.4683
Schistosoma mansoni sodium-dependent amino acid transporter 0.005 0.0575 0.066

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 5.35 nM Displacement of [3H]WIN from DAT in rat brain membrane ChEMBL. 16213721
Ki (binding) = 17.8 nM Displacement of [3H]Pirenzepine from Muscarinic receptor M1 ChEMBL. 16213721
Ki (binding) = 259 nM Displacement of [3H]Nisoxetine from NET ChEMBL. 16213721
Ki (binding) = 3010 nM Displacement of [3H]Citalopram from SERT ChEMBL. 16213721
Ratio Ki (binding) = 3 Selectivity of Muscarinic receptor M1 over DAT ChEMBL. 16213721
Ratio Ki (binding) = 48 Selectivity of NET over DAT ChEMBL. 16213721
Ratio Ki (binding) = 563 Selectivity of SERT over DAT ChEMBL. 16213721

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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