Detailed information for compound 1075377

Basic information

Technical information
  • TDR Targets ID: 1075377
  • Name: 1-cyclopropyl-1,2,3,4-tetrahydroisoquinoline
  • MW: 173.254 | Formula: C12H15N
  • H donors: 1 H acceptors: 0 LogP: 2.1 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: c1ccc2c(c1)C(NCC2)C1CC1
  • InChi: 1S/C12H15N/c1-2-4-11-9(3-1)7-8-13-12(11)10-5-6-10/h1-4,10,12-13H,5-8H2
  • InChiKey: KFPVVOFDTSXFCU-UHFFFAOYSA-N  


Substructure search Similarity search

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
Plasmodium falciparum phosphatidylinositol 3-kinase 0.004 0.1082 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0093 0.2929 0.2929
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0201 0.6702 0.67
Entamoeba histolytica hypothetical protein 0.018 0.5973 0.8911
Echinococcus multilocularis 0.0009 0.0004 0.0004
Schistosoma mansoni ap endonuclease 0.002 0.0397 0.0397
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.004 0.1082 0.1078
Echinococcus multilocularis 0.0015 0.0206 0.0209
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1364 0.1364
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.002 0.0397 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0015 0.0206 0.514
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1364 0.1364
Loa Loa (eye worm) CYP4Cod1 0.0024 0.0527 0.0527
Brugia malayi TAR-binding protein 0.0136 0.4443 0.4443
Brugia malayi Cytochrome P450 family protein 0.0035 0.0905 0.0905
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0397 0.0393
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0291 0.9845 0.9845
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0015 0.0206 0.0301
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.002 0.0397 0.0397
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.002 0.0397 0.3641
Loa Loa (eye worm) phosphatidylinositol 3 0.0052 0.1494 0.1494
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0291 0.9845 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.002 0.0397 0.0586
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.004 0.1082 0.1082
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0009 0.0004 0.0004
Entamoeba histolytica hypothetical protein 0.004 0.107 0.1591
Giardia lamblia Phosphoinositide-3-kinase, class 3 0.003 0.0733 0.1503
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1364 0.1385
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0291 0.9845 1
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0015 0.0206 0.514
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.004 0.1082 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0015 0.0206 0.0301
Brugia malayi RNA recognition motif domain containing protein 0.0136 0.4443 0.4443
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.002 0.0397 0.5
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Loa Loa (eye worm) TAR-binding protein 0.0136 0.4443 0.4443
Loa Loa (eye worm) cytochrome P450 0.0015 0.0206 0.0206
Onchocerca volvulus 0.0031 0.0771 1
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0009 0.0004 0.0004
Echinococcus multilocularis serine:threonine protein kinase SMG1 0.0009 0.0004 0.0004
Echinococcus granulosus cpg binding protein 0.0033 0.0833 0.0846
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0015 0.0206 0.514
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0015 0.0206 0.514
Schistosoma mansoni cytochrome P450 0.0015 0.0206 0.0206
Loa Loa (eye worm) phosphatidylinositol kinase 0.0009 0.0004 0.0004
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.1364 0.1385
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0018 0.0018
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0009 0.0004 0.0004
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0009 0.0004 0.0004
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0072 0.22 0.3278
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0015 0.0206 0.514
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0201 0.6702 1
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Loa Loa (eye worm) cytochrome P450 family protein 0.0024 0.0527 0.0527
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Schistosoma mansoni tar DNA-binding protein 0.0136 0.4443 0.4443
Echinococcus multilocularis tar DNA binding protein 0.0136 0.4443 0.4513
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.004 0.1082 0.1099
Leishmania major cytochrome p450-like protein 0.0024 0.0527 0.485
Brugia malayi hypothetical protein 0.004 0.107 0.107
Loa Loa (eye worm) MH2 domain-containing protein 0.0131 0.4275 0.4275
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0015 0.0206 0.1871
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0009 0.0004 0.0004
Brugia malayi exodeoxyribonuclease III family protein 0.002 0.0397 0.0397
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0061 0.1811 1
Schistosoma mansoni hypothetical protein 0.004 0.107 0.107
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0004
Echinococcus granulosus DNA dependent protein kinase catalytic subunit 0.0009 0.0004 0.0004
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0201 0.6702 0.67
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0169 0.5584 0.5582
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0009 0.0004 0.0004
Schistosoma mansoni phosphatidylinositol 4-kinase 0.004 0.1082 0.1082
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.002 0.0397 0.0403
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0015 0.0206 0.514
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0169 0.5584 0.5582
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0015 0.0206 0.514
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.1082 0.621
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1364 0.1385
Echinococcus granulosus serine protein kinase ATM 0.0009 0.0004 0.0004
Loa Loa (eye worm) cytochrome P450 family protein 0.0024 0.0527 0.0527
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.004 0.1082 0.5965
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.004 0.1082 0.1082
Trypanosoma cruzi cytochrome P450, putative 0.0024 0.0527 0.0781
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0015 0.0206 0.514
Mycobacterium leprae Conserved hypothetical protein 0.0015 0.0206 1
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.004 0.1082 0.1609
Toxoplasma gondii exonuclease III APE 0.002 0.0397 0.2261
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.1364 0.1364
Brugia malayi MH2 domain containing protein 0.0131 0.4275 0.4275
Echinococcus multilocularis DNA dependent protein kinase catalytic subunit 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0015 0.0206 0.514
Loa Loa (eye worm) cytochrome P450 family protein 0.0035 0.0905 0.0905
Schistosoma mansoni tar DNA-binding protein 0.0136 0.4443 0.4443
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Loa Loa (eye worm) histone methyltransferase 0.001 0.0023 0.0023
Loa Loa (eye worm) follicle stimulating hormone receptor 0.023 0.774 0.774
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Brugia malayi cytochrome P450 0.0015 0.0206 0.0206
Trypanosoma cruzi cytochrome P450, putative 0.0024 0.0527 0.0781
Leishmania major phosphatidylinositol 3-kinase, putative 0.004 0.1082 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0061 0.1811 0.2698
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0201 0.6702 1
Brugia malayi Cytochrome P450 family protein 0.0024 0.0527 0.0527
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.002 0.0397 0.0403
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0061 0.1811 0.1808
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0066 0.1985 0.1985
Trypanosoma brucei cytochrome P450, putative 0.0024 0.0527 0.2893
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.107 0.1087
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0015 0.0206 0.1116
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0024 0.0527 0.0328
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0397 0.3641
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0061 0.1811 0.2698
Echinococcus granulosus cytochrome P450 2K1 0.0015 0.0206 0.0209
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0093 0.2929 0.2975
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.002 0.0397 0.0195
Echinococcus multilocularis serine protein kinase ATM 0.0009 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0009 0.0004 0.0004
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.004 0.1082 0.1078
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0008
Brugia malayi follicle stimulating hormone receptor 0.023 0.774 0.774
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0009 0.0004 0.0004
Leishmania major cytochrome p450-like protein 0.0015 0.0206 0.1871
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0009 0.0004 0.0004
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.004 0.1082 0.1609
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0015 0.0206 0.514
Schistosoma mansoni tar DNA-binding protein 0.0136 0.4443 0.4443
Schistosoma mansoni hypothetical protein 0.0015 0.0206 0.0206
Entamoeba histolytica hypothetical protein 0.004 0.107 0.1591
Schistosoma mansoni ap endonuclease 0.002 0.0397 0.0397
Schistosoma mansoni hypothetical protein 0.0009 0.0004 0.0004
Loa Loa (eye worm) RNA binding protein 0.0136 0.4443 0.4443
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.002 0.0397 0.0586
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0201 0.6702 0.6702
Loa Loa (eye worm) hypothetical protein 0.0093 0.2929 0.2929
Entamoeba histolytica hypothetical protein 0.004 0.107 0.1591
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0061 0.1811 0.2698
Brugia malayi RNA binding protein 0.0136 0.4443 0.4443
Brugia malayi CXXC zinc finger family protein 0.0031 0.0771 0.0771
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.1364 0.1364
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0148 0.4855 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0031 0.0771 0.0771
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.004 0.1082 0.1078
Trypanosoma cruzi phosphatidylinositol 3-kinase, putative 0.0052 0.1494 0.2225
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0023 0.0023
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0015 0.0206 0.514
Echinococcus multilocularis Zinc finger, PHD finger 0.004 0.1082 0.1099
Brugia malayi Cytochrome P450 family protein 0.0015 0.0206 0.0206
Schistosoma mansoni fkbp-rapamycin associated protein 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0015 0.0206 0.514
Loa Loa (eye worm) transcription factor SMAD2 0.0131 0.4275 0.4275
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0015 0.0206 0.0301
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.018 0.5973 0.8911
Treponema pallidum exodeoxyribonuclease (exoA) 0.002 0.0397 0.5
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0015 0.0206 0.514
Schistosoma mansoni phosphatidylinositol 3-kinase class 0.0009 0.0004 0.0004
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0201 0.6702 1
Loa Loa (eye worm) hypothetical protein 0.0108 0.346 0.346
Toxoplasma gondii cytochrome p450 superfamily protein 0.0015 0.0206 0.1162
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.002 0.0397 0.0586
Schistosoma mansoni cpg binding protein 0.0033 0.0833 0.0833
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.004 0.1082 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.1364 0.1385
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0015 0.0206 0.514
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0061 0.1811 0.1808
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0061 0.1811 0.1811
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0015 0.0206 0.514
Entamoeba histolytica hypothetical protein 0.004 0.107 0.1591
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0015 0.0206 0.514
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.004 0.1082 0.1082
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.004 0.1082 0.621
Loa Loa (eye worm) phosphatidylinositol 3 0.027 0.9116 0.9116
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0015 0.0206 0.514
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0009 0.0004 0.0004
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0015 0.0206 0.514
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0009 0.0004 0.0004
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0201 0.6702 0.67
Echinococcus granulosus serine:threonine protein kinase SMG1 0.0009 0.0004 0.0004
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0009 0.0004 0.0004
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.004 0.1082 0.1609
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0093 0.2929 0.2975
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.002 0.0397 0.0809
Schistosoma mansoni tar DNA-binding protein 0.0136 0.4443 0.4443
Echinococcus granulosus tar DNA binding protein 0.0136 0.4443 0.4513
Mycobacterium leprae putative cytochrome p450 0.0015 0.0206 1
Schistosoma mansoni transcription factor LCR-F1 0.004 0.107 0.107
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0015 0.0206 0.514
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0061 0.1811 0.1808
Brugia malayi Cytochrome P450 family protein 0.0024 0.0527 0.0527
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0009 0.0004 0.0004
Leishmania major cytochrome p450-like protein 0.0015 0.0206 0.1871
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0192 0.6385 0.9527
Trichomonas vaginalis ap endonuclease, putative 0.002 0.0397 0.0393
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0061 0.1811 0.1811
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.107 0.1087
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.002 0.0397 0.3641
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.009 0.2831 0.2831
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0015 0.0206 0.514
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.004 0.1082 0.1099
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.004 0.1082 0.1099
Schistosoma mansoni cpg binding protein 0.0031 0.0771 0.0771
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0136 0.4443 0.4443
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.002 0.0397 0.2172
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.004 0.1082 0.1609
Schistosoma mansoni tar DNA-binding protein 0.0136 0.4443 0.4443
Loa Loa (eye worm) phosphatidylinositol 3 0.0009 0.0004 0.0004
Schistosoma mansoni cpg binding protein 0.0033 0.0833 0.0833
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.1364 0.1364
Echinococcus multilocularis cpg binding protein 0.0033 0.0833 0.0846
Toxoplasma gondii histone lysine methyltransferase SET1 0.0059 0.174 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0023 0.0023

Activities

No activities found for this compound.

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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