Detailed information for compound 166139

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 402.572 | Formula: C27H34N2O
  • H donors: 0 H acceptors: 1 LogP: 4.82 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(C1C(C1c1ccccc1)c1ccccc1)N([C@H]1CCCC[C@@H]1N1CCCC1)C
  • InChi: 1S/C27H34N2O/c1-28(22-16-8-9-17-23(22)29-18-10-11-19-29)27(30)26-24(20-12-4-2-5-13-20)25(26)21-14-6-3-7-15-21/h2-7,12-15,22-26H,8-11,16-19H2,1H3/t22-,23-,24?,25?,26?/m0/s1
  • InChiKey: WBABSZHKMKONHN-GVABRVPGSA-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
Homo sapiens opioid receptor, kappa 1 Starlite/ChEMBL No references

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
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0221 0.0204
Echinococcus granulosus peptidase Clp S14 family 0.0051 0.0431 0.0415
Echinococcus granulosus transient receptor potential gamma protein 0.0302 0.3256 0.3244
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0221 0.0204
Schistosoma mansoni transient receptor potential channel 0.0199 0.2106 0.2106
Trypanosoma cruzi cysteine peptidase, putative 0.0017 0.0045 0.0506
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.011 0.1102 0.3963
Echinococcus multilocularis inositol monophosphatase 1 0.0039 0.0295 0.0278
Brugia malayi F/Y-rich N-terminus family protein 0.0027 0.016 0.0429
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.014 0.1433 0.1419
Loa Loa (eye worm) hypothetical protein 0.0021 0.0095 0.0208
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0911 0.0895
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0075
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0095 0.0078
Loa Loa (eye worm) histone methyltransferase 0.0027 0.0164 0.0394
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0313 0.4134
Echinococcus granulosus short transient receptor potential channel 6 0.0199 0.2106 0.2092
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0313 0.1076
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.031 0.3351 0.8938
Echinococcus multilocularis dnaJ subfamily B 0.0844 0.9373 0.9372
Schistosoma mansoni transient receptor potential channel 0.0302 0.3256 0.3256
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0607 0.0607
Brugia malayi Ets-domain containing protein 0.0078 0.0736 0.2157
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0126 0.1275 0.126
Brugia malayi Cytochrome P450 family protein 0.0033 0.0232 0.0644
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0035 0.0249 0.0844
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0032 0.0221 0.2561
Echinococcus multilocularis protein dispatched 1 0.0054 0.0467 0.0451
Schistosoma mansoni loxhd1 0.0021 0.0095 0.0095
Entamoeba histolytica acetyltransferase, GNAT family 0.0039 0.0295 0.0936
Schistosoma mansoni ets-related 0.0237 0.2525 0.2525
Echinococcus granulosus histone acetyltransferase KAT2B 0.0042 0.0335 0.0318
Loa Loa (eye worm) hypothetical protein 0.0021 0.0095 0.0208
Trichomonas vaginalis bromodomain-containing protein, putative 0.0042 0.0335 0.8349
Plasmodium vivax multidomain scavenger receptor, putative 0.0021 0.0095 0.0723
Brugia malayi Cytochrome P450 family protein 0.0023 0.0116 0.0296
Brugia malayi RNA, U transporter 1 0.0092 0.0894 0.263
Toxoplasma gondii ABC1 family protein 0.004 0.0313 0.1685
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0253 0.2712 0.27
Onchocerca volvulus 0.004 0.0313 0.177
Brugia malayi acetyltransferase, GNAT family protein 0.0144 0.1479 0.4384
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Schistosoma mansoni inositol monophosphatase 0.0039 0.0295 0.0295
Schistosoma mansoni hypothetical protein 0.0098 0.0963 0.0963
Brugia malayi Doublecortin family protein 0.0021 0.0095 0.0233
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0045 0.0028
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0154 0.3122
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Echinococcus granulosus RUN 0.0021 0.0095 0.0078
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 1
Trypanosoma brucei cytochrome P450, putative 0.0023 0.0116 0.1778
Leishmania major cathepsin L-like protease 0.0017 0.0045 0.0506
Schistosoma mansoni peptidase Clp (S14 family) 0.0078 0.0733 0.0733
Brugia malayi beta-lactamase 0.004 0.0313 0.0887
Echinococcus granulosus Niemann Pick C1 protein 0.0158 0.1636 0.1621
Brugia malayi latrophilin 2 splice variant baaae 0.0212 0.2246 0.6685
Loa Loa (eye worm) doublecortin family protein 0.0021 0.0095 0.0208
Echinococcus multilocularis RUN 0.0021 0.0095 0.0078
Mycobacterium tuberculosis Conserved protein 0.004 0.0313 0.1076
Leishmania major importin beta-1 subunit, putative 0.0026 0.0154 0.2458
Echinococcus granulosus GA binding protein alpha chain 0.0078 0.0736 0.072
Echinococcus multilocularis short transient receptor potential channel 6 0.0199 0.2106 0.2092
Echinococcus granulosus sterol regulatory element binding protein 0.0047 0.0392 0.0375
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Leishmania major GTP-binding protein, putative 0.0024 0.0126 0.1966
Plasmodium vivax hypothetical protein, conserved 0.004 0.0313 0.3895
Plasmodium falciparum importin beta, putative 0.0032 0.0222 0.2577
Trichomonas vaginalis ran, putative 0.0024 0.0126 0.2334
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 1
Onchocerca volvulus 0.004 0.0313 0.177
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0313 0.1076
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Schistosoma mansoni polycystin 1-related 0.0021 0.0095 0.0095
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0024 0.0126 0.0109
Loa Loa (eye worm) hypothetical protein 0.0112 0.1122 0.2961
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0313 0.0793
Loa Loa (eye worm) hypothetical protein 0.0067 0.0609 0.1586
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0039 0.0295 0.1582
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0607 0.0607
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0222 0.3702
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0313 0.0313
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0911 0.0911
Loa Loa (eye worm) hypothetical protein 0.0098 0.0963 0.2536
Echinococcus multilocularis transcription factor eb 0.0108 0.1072 0.1057
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0024 0.0126 0.0621
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0022 0.0104 0.0087
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0095 0.0078
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0022 0.0104 0.0104
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0027 0.0159 0.1659
Brugia malayi TAR-binding protein 0.0066 0.0607 0.1769
Trichomonas vaginalis esterase, putative 0.004 0.0313 0.7723
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.031 0.3351 1
Brugia malayi CXXC zinc finger family protein 0.0088 0.0847 0.249
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0032 0.0221 0.3682
Loa Loa (eye worm) hypothetical protein 0.0078 0.0733 0.1917
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0258 0.2765 1
Toxoplasma gondii hypothetical protein 0.0027 0.0159 0.081
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0045 0.0028
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0027 0.0159 0.1659
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0024 0.0126 0.1966
Echinococcus granulosus transcription factor eb 0.0108 0.1072 0.1057
Schistosoma mansoni transient receptor potential channel 0.0199 0.2106 0.2106
Schistosoma mansoni transcription factor LCR-F1 0.0253 0.2712 0.2712
Leishmania major cathepsin L-like protease 0.0017 0.0045 0.0506
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0313 0.1076
Echinococcus multilocularis lipoxygenase domain containing protein 0.0021 0.0095 0.0078
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0022 0.0104 0.0087
Trichomonas vaginalis importin beta-1, putative 0.0026 0.0154 0.3122
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0313 0.7723
Echinococcus multilocularis cysteine protease 0.0017 0.0045 0.0028
Leishmania major hypothetical protein, conserved 0.004 0.0313 0.5336
Loa Loa (eye worm) CYP4Cod1 0.0023 0.0116 0.0264
Giardia lamblia Histone acetyltransferase GCN5 0.0039 0.0295 1
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0032 0.0221 0.2561
Echinococcus multilocularis tar DNA binding protein 0.0066 0.0607 0.0591
Mycobacterium ulcerans lipase LipD 0.004 0.0313 0.4134
Schistosoma mansoni hypothetical protein 0.0046 0.0373 0.0373
Loa Loa (eye worm) hypothetical protein 0.011 0.1102 0.2908
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Leishmania major cathepsin L-like protease 0.0017 0.0045 0.0506
Echinococcus multilocularis Niemann Pick C1 protein 0.0158 0.1636 0.1621
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0098 0.0963 0.2838
Plasmodium falciparum LCCL domain-containing protein 0.0021 0.0095 0.0723
Trypanosoma cruzi importin beta-1 subunit, putative 0.0026 0.0154 0.2458
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Echinococcus multilocularis transient receptor potential gamma protein 0.0302 0.3256 0.3244
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0313 0.0313
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0045 0.0045
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Brugia malayi Latrophilin receptor protein 2 0.0098 0.0963 0.2838
Mycobacterium ulcerans beta-lactamase 0.004 0.0313 0.4134
Schistosoma mansoni hypothetical protein 0.09 1 1
Schistosoma mansoni lipoxygenase 0.0126 0.1275 0.1275
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0313 0.1076
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0221 0.3682
Loa Loa (eye worm) latrophilin receptor protein 2 0.0098 0.0963 0.2536
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.0733 0.4077
Trypanosoma cruzi major cysteine proteinase, putative 0.005 0.0419 0.7245
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0126 0.1275 0.126
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0144 0.1479 0.1479
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Echinococcus multilocularis cpg binding protein 0.0093 0.0904 0.0888
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0024 0.0126 0.1177
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0607 0.0607
Schistosoma mansoni cpg binding protein 0.0093 0.0904 0.0904
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Brugia malayi Probable ClpP-like protease 0.0078 0.0733 0.2145
Brugia malayi hypothetical protein 0.0021 0.0095 0.0233
Schistosoma mansoni hypothetical protein 0.0098 0.0963 0.0963
Echinococcus multilocularis importin subunit beta 1 0.0032 0.0222 0.0205
Brugia malayi Inositol-1 0.0039 0.0295 0.0833
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0078 0.0733 0.4077
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0126 0.1966
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0116 0.0264
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Schistosoma mansoni hypothetical protein 0.0345 0.3748 0.3748
Schistosoma mansoni hypothetical protein 0.0021 0.0095 0.0095
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0911 0.0911
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0042 0.0335 0.1809
Brugia malayi Importin beta-1 subunit 0.0032 0.0222 0.0615
Loa Loa (eye worm) RNA binding protein 0.0066 0.0607 0.1581
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0032 0.0221 0.0204
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0154 0.3122
Echinococcus granulosus Protein patched homolog 1 0.0047 0.0392 0.0375
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0017 0.0045 0.0075
Brugia malayi beta-lactamase family protein 0.004 0.0313 0.0887
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0295 0.72
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Echinococcus granulosus lipoxygenase domain containing protein 0.0021 0.0095 0.0078
Loa Loa (eye worm) hypothetical protein 0.0189 0.1992 0.5294
Echinococcus multilocularis Niemann Pick C1 protein 0.011 0.1102 0.1087
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0313 0.0887
Echinococcus multilocularis expressed conserved protein 0.0104 0.1027 0.1011
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0911 0.0895
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0186 0.1956 0.1956
Echinococcus multilocularis snurportin 1 0.0345 0.3748 0.3737
Toxoplasma gondii isocitrate dehydrogenase 0.0032 0.0221 0.1163
Loa Loa (eye worm) hypothetical protein 0.0032 0.0222 0.055
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Schistosoma mansoni patched 1 0.0047 0.0392 0.0392
Echinococcus multilocularis cysteine protease 0.0017 0.0045 0.0028
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Echinococcus multilocularis protein patched 0.0047 0.0392 0.0375
Loa Loa (eye worm) isocitrate dehydrogenase 0.0032 0.0221 0.0547
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0042 0.0335 0.4211
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0078 0.0736 0.1928
Echinococcus multilocularis geminin 0.09 1 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0051 0.0431 0.5788
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0023 0.0116 0.1378
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0051 0.0431 0.1507
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0047 0.0392 0.1004
Echinococcus granulosus Niemann Pick C1 protein 0.011 0.1102 0.1087
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0093 0.0911 0.0895
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Echinococcus multilocularis Polycystic kidney disease protein 0.0021 0.0095 0.0078
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0222 0.3702
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0116 0.1778
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0098 0.0963 0.0948
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0313 0.5336
Schistosoma mansoni hypothetical protein 0.0014 0.0017 0.0017
Loa Loa (eye worm) CXXC zinc finger family protein 0.0088 0.0847 0.2225
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0313 0.4134
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 1
Loa Loa (eye worm) fli-1 protein 0.0237 0.2525 0.6721
Loa Loa (eye worm) hypothetical protein 0.0212 0.2246 0.5975
Schistosoma mansoni gabp alpha 0.0078 0.0736 0.0736
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 0.5
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0027 0.0164 0.0147
Entamoeba histolytica hypothetical protein 0.0253 0.2712 1
Echinococcus granulosus Polycystic kidney disease protein 0.0021 0.0095 0.0078
Schistosoma mansoni hypothetical protein 0.0098 0.0963 0.0963
Toxoplasma gondii HEAT repeat-containing protein 0.0032 0.0222 0.1169
Brugia malayi Transient-receptor-potential like protein 0.0112 0.1122 0.3313
Echinococcus granulosus GPCR family 2 0.0098 0.0963 0.0948
Echinococcus multilocularis GA binding protein alpha chain 0.0078 0.0736 0.072
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0032 0.0221 0.3682
Brugia malayi isocitrate dehydrogenase 0.0032 0.0221 0.0612
Echinococcus granulosus GTP binding nuclear protein Ran 0.0024 0.0126 0.0109
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0093 0.0911 0.2679
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 1
Schistosoma mansoni cpg binding protein 0.0093 0.0904 0.0904
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0035 0.0249 0.3241
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Trypanosoma cruzi cysteine peptidase, putative 0.0063 0.0572 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.031 0.3351 1
Schistosoma mansoni hypothetical protein 0.0253 0.2712 0.2712
Echinococcus granulosus expressed conserved protein 0.0104 0.1027 0.1011
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0313 0.0296
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Entamoeba histolytica hypothetical protein 0.0253 0.2712 1
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0313 0.5336
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0313 0.1076
Brugia malayi hypothetical protein 0.0151 0.1558 0.462
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0042 0.0335 0.8349
Loa Loa (eye worm) TAR-binding protein 0.0066 0.0607 0.1581
Echinococcus granulosus dnaJ subfamily B 0.0844 0.9373 0.9372
Brugia malayi beta-lactamase family protein 0.004 0.0313 0.0887
Loa Loa (eye worm) helix-loop-helix DNA-binding domain-containing protein 0.0107 0.1066 0.2812
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0024 0.0126 0.0327
Brugia malayi Papain family cysteine protease containing protein 0.0017 0.0045 0.0084
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0042 0.0335 0.1809
Schistosoma mansoni ran 0.0024 0.0126 0.0126
Loa Loa (eye worm) hypothetical protein 0.031 0.3351 0.8938
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0039 0.0295 0.3881
Echinococcus granulosus importin subunit beta 1 0.0032 0.0222 0.0205
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0607 0.0607
Brugia malayi Isocitrate dehydrogenase 0.0032 0.0221 0.0612
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0078 0.0733 1
Schistosoma mansoni hypothetical protein 0.0046 0.0373 0.0373
Schistosoma mansoni cpg binding protein 0.0088 0.0847 0.0847
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0126 0.1966
Trichomonas vaginalis inositol monophosphatase, putative 0.0039 0.0295 0.72
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0024 0.0126 0.1177
Schistosoma mansoni transient receptor potential channel 4 0.0302 0.3256 0.3256
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.002 0.0082 0.1064
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0045 0.0045
Plasmodium falciparum histone acetyltransferase GCN5 0.0039 0.0295 0.3633
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 1
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0313 0.1076
Schistosoma mansoni hypothetical protein 0.09 1 1
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0313 0.0296
Leishmania major cytochrome p450-like protein 0.0023 0.0116 0.1778
Echinococcus granulosus transient receptor potential ion channel A 0.0291 0.3143 0.3131
Loa Loa (eye worm) beta-lactamase 0.004 0.0313 0.0793
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0032 0.0221 0.0221
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0045 0.0028
Leishmania major cathepsin L-like protease 0.0017 0.0045 0.0506
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0078 0.0733 0.5
Entamoeba histolytica hypothetical protein 0.0253 0.2712 1
Schistosoma mansoni lipoxygenase 0.0088 0.0849 0.0849
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0078 0.0733 0.0717
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0022 0.0104 0.0087
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0221 0.0204
Onchocerca volvulus 0.004 0.0313 0.177
Mycobacterium leprae Probable lipase LipE 0.004 0.0313 0.4134
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0027 0.0164 0.0147
Echinococcus multilocularis peptidase Clp (S14 family) 0.0051 0.0431 0.0415
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0295 0.5009
Onchocerca volvulus 0.0088 0.0847 0.5303
Brugia malayi Helix-loop-helix DNA-binding domain containing protein 0.0108 0.1072 0.3164
Loa Loa (eye worm) cysteine protease 0.0017 0.0045 0.0075
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.002 0.0082 0.1064
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0112 0.1121 0.1121
Schistosoma mansoni importin beta-1 0.0032 0.0222 0.0222
Echinococcus granulosus tar DNA binding protein 0.0066 0.0607 0.0591
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0295 0.5009
Schistosoma mansoni hypothetical protein 0.0046 0.0373 0.0373
Brugia malayi hypothetical protein 0.0253 0.2712 0.8083
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0017 0.0045 0.0075
Brugia malayi CHE-14 protein 0.0047 0.0392 0.1124
Plasmodium vivax importin-beta 2, putative 0.0032 0.0222 0.2577
Mycobacterium tuberculosis Conserved protein 0.004 0.0313 0.1076
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0024 0.0126 0.0292
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0392 1
Brugia malayi Fli-1 protein 0.0237 0.2525 0.7521
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0078 0.0733 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0045 0.0084
Schistosoma mansoni inositol monophosphatase 0.0039 0.0295 0.0295
Echinococcus granulosus mixed lineage leukemia protein mll 0.0022 0.0104 0.0087
Schistosoma mansoni hypothetical protein 0.0098 0.0963 0.0963
Echinococcus granulosus snurportin 1 0.0345 0.3748 0.3737
Loa Loa (eye worm) hypothetical protein 0.0107 0.1066 0.2812
Schistosoma mansoni hypothetical protein 0.0046 0.0373 0.0373
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0313 0.7723
Echinococcus granulosus cathepsin l1 0.0017 0.0045 0.0028
Echinococcus multilocularis TRP (transient receptor potential) channel 0.0112 0.1122 0.1106
Onchocerca volvulus 0.0021 0.0095 0.0328
Entamoeba histolytica hypothetical protein 0.0253 0.2712 1
Toxoplasma gondii isocitrate dehydrogenase 0.0032 0.0221 0.1163
Loa Loa (eye worm) hypothetical protein 0.0058 0.0512 0.1326
Onchocerca volvulus 0.0021 0.0095 0.0328
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0313 0.7723
Toxoplasma gondii histone lysine methyltransferase SET1 0.017 0.1772 1
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0078 0.0733 0.0717
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0039 0.0295 0.0936
Schistosoma mansoni rab6-interacting 0.0021 0.0095 0.0095
Schistosoma mansoni rab6-interacting 0.0021 0.0095 0.0095
Loa Loa (eye worm) acetyltransferase 0.0144 0.1479 0.3918
Loa Loa (eye worm) hypothetical protein 0.004 0.0313 0.0793
Schistosoma mansoni tar DNA-binding protein 0.0066 0.0607 0.0607
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0093 0.0911 0.2395
Loa Loa (eye worm) hypothetical protein 0.0047 0.0392 0.1004
Loa Loa (eye worm) hypothetical protein 0.0302 0.3256 0.8682
Mycobacterium leprae conserved hypothetical protein 0.004 0.0313 0.4134
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Brugia malayi RNA binding protein 0.0066 0.0607 0.1769
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0221 0.3682
Loa Loa (eye worm) fibroinase 0.0017 0.0045 0.0075
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0098 0.0963 0.0948
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0313 0.7723
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0058 0.051 0.8883
Echinococcus granulosus cathepsin L cysteine proteinase 0.0017 0.0045 0.0028
Loa Loa (eye worm) ctsf protein 0.0017 0.0045 0.0075
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0345 0.3748 1
Echinococcus multilocularis transient receptor potential ion channel A 0.0291 0.3143 0.3131
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0144 0.1479 0.1464
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0032 0.0221 0.0743
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0032 0.0221 0.0204
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Trypanosoma cruzi cruzipain precursor, putative 0.0063 0.0572 1
Onchocerca volvulus 0.0151 0.1558 1
Mycobacterium ulcerans hypothetical protein 0.004 0.0313 0.4134
Brugia malayi Cytochrome P450 family protein 0.0023 0.0116 0.0296
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0313 0.1076
Leishmania major cysteine peptidase A (CPA) 0.0017 0.0045 0.0506
Schistosoma mansoni hypothetical protein 0.0212 0.2246 0.2246
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0027 0.0159 0.1986
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0093 0.0911 0.0911
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Echinococcus multilocularis short transient receptor potential channel 6 0.0199 0.2106 0.2092
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0066 0.0607 0.1581
Loa Loa (eye worm) inositol-1 0.0039 0.0295 0.0744
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0295 0.72
Mycobacterium tuberculosis Conserved protein 0.004 0.0313 0.1076
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0093 0.0911 0.0895
Echinococcus multilocularis GPCR, family 2 0.0098 0.0963 0.0948
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0116 0.0264
Leishmania major cathepsin L-like protease 0.0063 0.0572 1
Schistosoma mansoni cytochrome P450 0.0014 0.0017 0.0017
Loa Loa (eye worm) hypothetical protein 0.0102 0.1009 0.2657
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0082 0.1064
Brugia malayi RNA recognition motif domain containing protein 0.0066 0.0607 0.1769
Echinococcus multilocularis sterol regulatory element binding protein 0.0047 0.0392 0.0375
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0051 0.0431 0.1507
Echinococcus granulosus TRP transient receptor potential channel 0.0112 0.1122 0.1106
Entamoeba histolytica Ran family GTPase 0.0024 0.0126 0.0303
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0295 0.5009
Toxoplasma gondii cathepsin CPL 0.0017 0.0045 0.016
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0063 0.0572 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0221 0.3682
Loa Loa (eye worm) hypothetical protein 0.0151 0.1558 0.4129
Schistosoma mansoni ran 0.0024 0.0126 0.0126
Echinococcus multilocularis isocitrate dehydrogenase 0.0032 0.0221 0.0204
Leishmania major cathepsin L-like protease 0.0017 0.0045 0.0506
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0253 0.2712 0.27
Brugia malayi Ets-domain containing protein 0.0078 0.0736 0.2157
Echinococcus granulosus cathepsin l cysteine peptidase 0.0017 0.0045 0.0028
Brugia malayi hypothetical protein 0.0021 0.0095 0.0233
Trypanosoma cruzi cytochrome P450, putative 0.0023 0.0116 0.1778
Echinococcus granulosus inositol monophosphatase 1 0.0039 0.0295 0.0278
Brugia malayi Niemann-Pick C1 protein precursor 0.011 0.1102 0.3254
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.002 0.0082 0.1064
Echinococcus granulosus short transient receptor potential channel 6 0.0199 0.2106 0.2092
Loa Loa (eye worm) cytochrome P450 family protein 0.0033 0.0232 0.0575
Echinococcus granulosus cpg binding protein 0.0093 0.0904 0.0888
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0098 0.0963 0.0948
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0295 0.5009
Trichomonas vaginalis helicase, putative 0.002 0.0082 0.1064
Entamoeba histolytica hypothetical protein 0.0026 0.0154 0.0406
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0098 0.0963 0.0948
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0313 0.5336
Schistosoma mansoni hypothetical protein 0.0844 0.9373 0.9373
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0313 0.7723
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0045 0.0028

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 10 uM Inhibition of Opioid receptor kappa 1 as reduced contraction in electrically stimulated rabbit vas deferens ChEMBL. No reference
EC50 (functional) > 10 uM Inhibition of Opioid receptor kappa 1 as reduced contraction in electrically stimulated rabbit vas deferens ChEMBL. No reference

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

No external resources registered for this compound

Bibliographic References

No literature references available for this target.

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