Detailed information for compound 2131628

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 207.162 | Formula: C13H21NO
  • H donors: 0 H acceptors: 0 LogP: 2.88 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 0
  • SMILES: COc1ccc(cc1)C(CCN(C)C)C
  • InChi: InChI=1S/C13H21NO/c1-11(9-10-14(2)3)12-5-7-13(15-4)8-6-12/h5-8,11H,9-10H2,1-4H3
  • InChiKey: ZFADUGUMNOQQHE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Cavia porcellus Sigma-1 receptor References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania mexicana C-8 sterol isomerase-like protein Get druggable targets OG5_131051 All targets in OG5_131051
Leishmania major C-8 sterol isomerase-like protein Get druggable targets OG5_131051 All targets in OG5_131051
Brugia malayi ERG2 and Sigma1 receptor like protein Get druggable targets OG5_131051 All targets in OG5_131051
Leishmania braziliensis C-8 sterol isomerase-like protein Get druggable targets OG5_131051 All targets in OG5_131051
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131051 All targets in OG5_131051
Trypanosoma cruzi C-8 sterol isomerase, putative Get druggable targets OG5_131051 All targets in OG5_131051
Leishmania infantum C-8 sterol isomerase-like protein Get druggable targets OG5_131051 All targets in OG5_131051
Trypanosoma brucei C-8 sterol isomerase, putative Get druggable targets OG5_131051 All targets in OG5_131051
Leishmania donovani C-8 sterol isomerase-like protein Get druggable targets OG5_131051 All targets in OG5_131051
Candida albicans sterol C8-C7 isomerase Get druggable targets OG5_131051 All targets in OG5_131051
Candida albicans sterol C8-C7 isomerase Get druggable targets OG5_131051 All targets in OG5_131051
Trypanosoma congolense C-8 sterol isomerase, putative Get druggable targets OG5_131051 All targets in OG5_131051
Trypanosoma brucei gambiense C-8 sterol isomerase, putative Get druggable targets OG5_131051 All targets in OG5_131051
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131051 All targets in OG5_131051
Trypanosoma congolense C-8 sterol isomerase, putative Get druggable targets OG5_131051 All targets in OG5_131051
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0703 0.1638
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.004 0.0477 0.1749
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.004 0.0477 0.2184
Trypanosoma cruzi cytochrome p450-like protein, putative 0.004 0.0477 0.0494
Leishmania major C-8 sterol isomerase-like protein 0.0445 0.8287 1
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.004 0.0477 0.2184
Schistosoma mansoni tar DNA-binding protein 0.0219 0.3927 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0067 0.1002 0.2413
Echinococcus multilocularis GPCR, family 2 0.0072 0.1088 0.1045
Echinococcus multilocularis neuropeptide s receptor 0.0523 0.9801 1
Toxoplasma gondii cytochrome p450 superfamily protein 0.004 0.0477 0.4359
Brugia malayi TAR-binding protein 0.0219 0.3927 0.4488
Plasmodium vivax flap endonuclease 1, putative 0.0028 0.0237 0.1783
Leishmania major cytochrome p450-like protein 0.004 0.0477 0.0494
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0703 0.0649
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0037 0.0426 0.1102
Loa Loa (eye worm) glutathione reductase 0.0055 0.0764 0.0873
Leishmania major cytochrome p450-like protein 0.004 0.0477 0.0494
Loa Loa (eye worm) latrophilin receptor protein 2 0.0072 0.1088 0.1243
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0072 0.1088 0.1045
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.004 0.0477 0.1749
Echinococcus granulosus thioredoxin glutathione reductase 0.0055 0.0764 0.0711
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.004 0.0477 0.2184
Loa Loa (eye worm) hypothetical protein 0.0072 0.1088 0.1243
Echinococcus granulosus neuropeptide s receptor 0.0523 0.9801 1
Loa Loa (eye worm) cytochrome P450 family protein 0.006 0.086 0.0982
Plasmodium falciparum flap endonuclease 1 0.0028 0.0237 0.2397
Trypanosoma brucei C-8 sterol isomerase, putative 0.0445 0.8287 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0227 0.4076 0.4658
Schistosoma mansoni hypothetical protein 0.0072 0.1088 0.2636
Mycobacterium ulcerans 6-phosphofructokinase 0.0115 0.1929 1
Trypanosoma brucei trypanothione reductase 0.0055 0.0764 0.0842
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0115 0.1929 0.2261
Brugia malayi Pre-SET motif family protein 0.0067 0.1002 0.1145
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.004 0.0477 0.1749
Echinococcus multilocularis neuropeptide receptor A26 0.0523 0.9801 1
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.004 0.0477 0.2184
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0065 0.0954 0.0907
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.004 0.0477 0.2184
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0031 0.0305 0.1259
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0088 0.1406 0.3461
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0031 0.0305 0.2515
Loa Loa (eye worm) hypothetical protein 0.013 0.2212 0.2528
Echinococcus granulosus flap endonuclease 1 0.0028 0.0237 0.0171
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0511 0.0535
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.004 0.0477 0.1749
Trichomonas vaginalis flap endonuclease-1, putative 0.0028 0.0237 0.0167
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0305 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0072 0.1088 0.1045
Brugia malayi latrophilin 2 splice variant baaae 0.0155 0.2693 0.3078
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0511 0.0443
Loa Loa (eye worm) hypothetical protein 0.002 0.0087 0.0099
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.004 0.0477 0.2184
Echinococcus granulosus lamin 0.0029 0.0256 0.019
Brugia malayi Inositol-1 0.0042 0.0511 0.0584
Brugia malayi 6-phosphofructokinase 0.0115 0.1929 0.2204
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0025 0.0183 0.0481
Echinococcus granulosus inositol monophosphatase 1 0.0042 0.0511 0.0452
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0305 0.2515
Loa Loa (eye worm) hypothetical protein 0.0067 0.1002 0.1145
Brugia malayi Cytochrome P450 family protein 0.006 0.086 0.0982
Onchocerca volvulus 0.0067 0.1002 0.0765
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0042 0.0511 0.1878
Echinococcus multilocularis thioredoxin glutathione reductase 0.0055 0.0764 0.0711
Echinococcus multilocularis 0.004 0.0477 0.0417
Loa Loa (eye worm) hypothetical protein 0.0445 0.8287 0.9471
Schistosoma mansoni hypothetical protein 0.004 0.0477 0.1052
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.004 0.0477 0.0494
Brugia malayi Intermediate filament tail domain containing protein 0.0029 0.0256 0.0293
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.004 0.0477 0.1749
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.004 0.0477 0.1749
Entamoeba histolytica phosphofructokinase, putative 0.0115 0.1929 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0227 0.4076 0.4658
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0067 0.1002 0.2413
Loa Loa (eye worm) TAR-binding protein 0.0219 0.3927 0.4488
Leishmania major trypanothione reductase 0.0055 0.0764 0.0842
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0115 0.1929 1
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.004 0.0477 0.1749
Trypanosoma cruzi cytochrome P450, putative 0.006 0.086 0.0959
Schistosoma mansoni lamin 0.0029 0.0256 0.0479
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.0703 0.0803
Loa Loa (eye worm) inositol-1 0.0042 0.0511 0.0584
Schistosoma mansoni tar DNA-binding protein 0.0219 0.3927 1
Loa Loa (eye worm) phosphofructokinase 0.0115 0.1929 0.2204
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.004 0.0477 0.2184
Trypanosoma brucei cytochrome P450, putative 0.006 0.086 0.0959
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0139 0.239 1
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0055 0.0764 0.2985
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0125 0.2121 0.8837
Schistosoma mansoni tar DNA-binding protein 0.0219 0.3927 1
Brugia malayi intermediate filament protein 0.0029 0.0256 0.0293
Echinococcus granulosus intermediate filament protein 0.0029 0.0256 0.019
Schistosoma mansoni cytochrome P450 0.004 0.0477 0.1052
Mycobacterium leprae Conserved hypothetical protein 0.004 0.0477 0.1332
Echinococcus multilocularis L aminoadipate semialdehyde 0.0088 0.1406 0.1372
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0067 0.1002 0.0956
Plasmodium vivax thioredoxin reductase, putative 0.0055 0.0764 0.7439
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0067 0.1002 0.0956
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.004 0.0477 0.2184
Brugia malayi hypothetical protein 0.013 0.2212 0.2528
Plasmodium vivax 6-phosphofructokinase, putative 0.0031 0.0305 0.2515
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.004 0.0477 0.2184
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0072 0.1088 0.1045
Loa Loa (eye worm) cytochrome P450 0.004 0.0477 0.0545
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.004 0.0477 0.2184
Echinococcus granulosus L aminoadipate semialdehyde 0.0088 0.1406 0.1372
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0133 0.2281 0.2271
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.006 0.086 0.4243
Onchocerca volvulus Huntingtin homolog 0.013 0.2212 0.2007
Brugia malayi Cytochrome P450 family protein 0.006 0.086 0.0982
Echinococcus granulosus histone lysine methyltransferase setb 0.0067 0.1002 0.0956
Schistosoma mansoni tar DNA-binding protein 0.0219 0.3927 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0125 0.2121 0.8778
Schistosoma mansoni flap endonuclease-1 0.0025 0.0186 0.0298
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.004 0.0477 0.2184
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0703 0.0649
Brugia malayi Flap endonuclease-1 0.0028 0.0237 0.0271
Chlamydia trachomatis holo [acyl-carrier protein] synthase 0.0025 0.0183 0.4767
Loa Loa (eye worm) hypothetical protein 0.0029 0.0256 0.0293
Echinococcus granulosus neuropeptide receptor A26 0.0523 0.9801 1
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0511 0.0535
Trichomonas vaginalis phosphofructokinase, putative 0.0115 0.1929 0.1871
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.004 0.0477 0.1749
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0031 0.0305 0.0701
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.004 0.0477 0.1749
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0511 0.0535
Mycobacterium tuberculosis Probable oxidoreductase 0.0139 0.239 1
Toxoplasma gondii thioredoxin reductase 0.0055 0.0764 0.7439
Trypanosoma cruzi trypanothione reductase, putative 0.0055 0.0764 0.0842
Schistosoma mansoni inositol monophosphatase 0.0042 0.0511 0.114
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.004 0.0477 0.1749
Trypanosoma cruzi C-8 sterol isomerase, putative 0.0445 0.8287 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0144 0.2488 0.2484
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0703 0.1638
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0115 0.1929 0.7911
Loa Loa (eye worm) cytochrome P450 family protein 0.0126 0.2143 0.245
Trypanosoma brucei hypothetical protein, conserved 0.0025 0.0183 0.0136
Loa Loa (eye worm) 6-phosphofructokinase 0.0115 0.1929 0.2204
Schistosoma mansoni inositol monophosphatase 0.0042 0.0511 0.114
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.004 0.0477 0.2184
Brugia malayi Cytochrome P450 family protein 0.004 0.0477 0.0545
Mycobacterium tuberculosis Probable dehydrogenase 0.0125 0.2121 0.8837
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.004 0.0477 0.2184
Toxoplasma gondii phosphofructokinase PFKII 0.0031 0.0305 0.2515
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0067 0.1002 0.2413
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.004 0.0477 0.2184
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.004 0.0477 0.1749
Schistosoma mansoni hypothetical protein 0.0133 0.2281 0.573
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0042 0.0511 1
Schistosoma mansoni tar DNA-binding protein 0.0219 0.3927 1
Schistosoma mansoni intermediate filament proteins 0.0029 0.0256 0.0479
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.004 0.0477 0.1749
Echinococcus granulosus 6 phosphofructokinase 0.0115 0.1929 0.1909
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0025 0.0183 0.1611
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.0703 0.0803
Onchocerca volvulus 0.0088 0.1406 0.118
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0067 0.1002 1
Loa Loa (eye worm) RNA binding protein 0.0219 0.3927 0.4488
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Trichomonas vaginalis inositol monophosphatase, putative 0.0042 0.0511 0.0443
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.004 0.0477 0.1749
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Loa Loa (eye worm) CYP4Cod1 0.006 0.086 0.0982
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0029 0.0256 0.0293
Trichomonas vaginalis set domain proteins, putative 0.0533 1 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0028 0.0237 0.0202
Loa Loa (eye worm) thioredoxin reductase 0.0055 0.0764 0.0873
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0031 0.0305 1
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0125 0.2121 0.8837
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0025 0.0183 0.06
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0025 0.0183 0.1199
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0139 0.239 1
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0088 0.1406 0.1607
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0042 0.0511 0.0443
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.004 0.0477 0.1749
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0703 0.0649
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0031 0.0305 1
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.004 0.0477 0.1749
Plasmodium falciparum thioredoxin reductase 0.0055 0.0764 1
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.004 0.0477 0.1749
Brugia malayi RNA binding protein 0.0219 0.3927 0.4488
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0305 0.338
Schistosoma mansoni lamin 0.0029 0.0256 0.0479
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0125 0.2121 0.8837
Loa Loa (eye worm) hypothetical protein 0.0227 0.4076 0.4658
Trypanosoma cruzi cytochrome P450, putative 0.006 0.086 0.0959
Leishmania major cytochrome p450-like protein 0.006 0.086 0.0959
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0037 0.0426 0.153
Schistosoma mansoni 6-phosphofructokinase 0.0115 0.1929 0.4817
Schistosoma mansoni thyroid hormone receptor 0.0144 0.2488 0.6267
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.004 0.0477 0.2184
Entamoeba histolytica phosphofructokinase, putative 0.0115 0.1929 1
Plasmodium vivax glutathione reductase, putative 0.0055 0.0764 0.7439
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.004 0.0477 0.1749
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0031 0.0305 0.338
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.004 0.0477 0.1749
Echinococcus granulosus tar DNA binding protein 0.0219 0.3927 0.3963
Trichomonas vaginalis phosphofructokinase, putative 0.0115 0.1929 0.1871
Plasmodium falciparum glutathione reductase 0.0055 0.0764 1
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.004 0.0477 0.2184
Giardia lamblia Flap structure-specific endonuclease 0.0028 0.0237 0.7092
Entamoeba histolytica phosphofructokinase, putative 0.0115 0.1929 1
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0115 0.1929 0.8011
Schistosoma mansoni hypothetical protein 0.0155 0.2693 0.6799
Leishmania major ATP-dependent phosphofructokinase 0.0115 0.1929 0.2261
Echinococcus granulosus GPCR family 2 0.0072 0.1088 0.1045
Onchocerca volvulus Huntingtin homolog 0.013 0.2212 0.2007
Echinococcus multilocularis 6 phosphofructokinase 0.0115 0.1929 0.1909
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0028 0.0237 0.0202
Loa Loa (eye worm) intermediate filament protein 0.0029 0.0256 0.0293
Toxoplasma gondii 6-phosphofructokinase 0.0031 0.0305 0.2515
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.004 0.0477 0.2184
Loa Loa (eye worm) hypothetical protein 0.0088 0.1406 0.1607
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0025 0.0183 0.2538
Echinococcus multilocularis lamin dm0 0.0029 0.0256 0.019
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0125 0.2121 0.8837
Leishmania major phosphopantetheinyl transferase-like protein 0.0025 0.0183 0.0136
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.004 0.0477 0.0494
Loa Loa (eye worm) hypothetical protein 0.0227 0.4091 0.4675
Schistosoma mansoni thyroid hormone receptor 0.0144 0.2488 0.6267
Brugia malayi RNA recognition motif domain containing protein 0.0219 0.3927 0.4488
Echinococcus granulosus cytochrome P450 2K1 0.004 0.0477 0.0417
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0469 0.875 1
Schistosoma mansoni hypothetical protein 0.0072 0.1088 0.2636
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Plasmodium vivax SET domain protein, putative 0.0067 0.1002 1
Schistosoma mansoni 6-phosphofructokinase 0.0115 0.1929 0.4817
Brugia malayi Pre-SET motif family protein 0.0469 0.875 1
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0028 0.0237 0.0202
Echinococcus multilocularis lamin 0.0029 0.0256 0.019
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.0703 0.0649
Brugia malayi cytochrome P450 0.004 0.0477 0.0545
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0019 0.0071 0.0082
Echinococcus multilocularis flap endonuclease 1 0.0028 0.0237 0.0171
Echinococcus multilocularis musashi 0.0029 0.0256 0.019
Echinococcus granulosus lamin dm0 0.0029 0.0256 0.019
Echinococcus multilocularis inositol monophosphatase 1 0.0042 0.0511 0.0452
Brugia malayi Thioredoxin reductase 0.0055 0.0764 0.0873
Schistosoma mansoni hypothetical protein 0.0072 0.1088 0.2636
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0133 0.2281 0.2271
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0139 0.239 1
Loa Loa (eye worm) cytochrome P450 family protein 0.006 0.086 0.0982
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.004 0.0477 0.2184
Mycobacterium leprae putative cytochrome p450 0.004 0.0477 0.1332
Brugia malayi glutathione reductase 0.0055 0.0764 0.0873
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0025 0.0183 0.06
Schistosoma mansoni hypothetical protein 0.0072 0.1088 0.2636
Brugia malayi phosphofructokinase 0.0115 0.1929 0.2204
Loa Loa (eye worm) 6-phosphofructokinase 0.0115 0.1929 0.2204
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0042 0.0511 0.0535
Loa Loa (eye worm) flap endonuclease-1 0.0028 0.0237 0.0271
Echinococcus multilocularis tar DNA binding protein 0.0219 0.3927 0.3963
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0072 0.1088 0.1243
Loa Loa (eye worm) hypothetical protein 0.0028 0.0246 0.0281
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0025 0.0183 0.1199
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.004 0.0477 0.2184
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0072 0.1088 0.1045
Leishmania major lanosterol 14-alpha-demethylase, putative 0.004 0.0477 0.0494
Brugia malayi 6-phosphofructokinase 0.0115 0.1929 0.2204
Brugia malayi Cytochrome P450 family protein 0.0126 0.2143 0.245
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0028 0.0237 0.1783
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0067 0.1002 0.2413
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.0703 0.1638
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.004 0.0477 0.0494
Entamoeba histolytica Flap nuclease, putative 0.0028 0.0237 0.0312
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0227 0.4076 0.4658
Trichomonas vaginalis phosphofructokinase, putative 0.0115 0.1929 0.1871
Brugia malayi ERG2 and Sigma1 receptor like protein 0.0445 0.8287 0.9471
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.004 0.0477 0.1749
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0042 0.0511 0.4722
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.004 0.0477 0.2184
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0115 0.1929 0.2261
Loa Loa (eye worm) hypothetical protein 0.0155 0.2693 0.3078
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.004 0.0477 0.1749
Trichomonas vaginalis phosphofructokinase, putative 0.0115 0.1929 0.1871
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0219 0.3927 0.4488
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0042 0.0511 0.2365
Brugia malayi Latrophilin receptor protein 2 0.0072 0.1088 0.1243
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0025 0.0183 0.06
Mycobacterium tuberculosis Probable reductase 0.0125 0.2121 0.8837
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0031 0.0305 0.0236
Trichomonas vaginalis phosphofructokinase, putative 0.0031 0.0305 0.0236
Loa Loa (eye worm) hypothetical protein 0.013 0.2212 0.2528
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0025 0.0183 0.1199

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 116 nM Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in guinea pig cerebral cortex membranes after 120 mins by scintillation counting analysis LITERATURE. 27838169

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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