Detailed information for compound 21177

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 378.507 | Formula: C24H30N2O2
  • H donors: 2 H acceptors: 1 LogP: 5.25 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(=O)NC[C@@H]1C[C@@H]1c1cccc2c1OC(N2)CCCCc1ccccc1
  • InChi: 1S/C24H30N2O2/c1-2-22(27)25-16-18-15-20(18)19-12-8-13-21-24(19)28-23(26-21)14-7-6-11-17-9-4-3-5-10-17/h3-5,8-10,12-13,18,20,23,26H,2,6-7,11,14-16H2,1H3,(H,25,27)/t18-,20+,23?/m0/s1
  • InChiKey: KOEYXTZAIOHZLZ-CDOORCJHSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

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
Brugia malayi hypothetical protein 0.0025 0.0059 0.0128
Schistosoma mansoni ADAM17 peptidase (M12 family) 0.0187 0.0928 0.3479
Loa Loa (eye worm) zinc metallopeptidase 4 0.007 0.0298 0.065
Loa Loa (eye worm) hypothetical protein 0.0142 0.0687 0.1499
Loa Loa (eye worm) hypothetical protein 0.005 0.0193 0.0421
Echinococcus multilocularis lamin dm0 0.0027 0.0068 0.0088
Trichomonas vaginalis DNA helicase recq, putative 0.002 0.0029 0.0156
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0059 0.0128
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0026 0.007
Mycobacterium ulcerans hydrolase 0.0435 0.227 0.2262
Loa Loa (eye worm) hypothetical protein 0.0027 0.0066 0.0143
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0059 0.0048
Brugia malayi hypothetical protein 0.0035 0.0112 0.0243
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0026 0.007
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0084 0.029
Echinococcus multilocularis Regulator of G protein signaling 20 0.0019 0.0026 0.0027
Echinococcus granulosus leucine aminopeptidase protein 0.0107 0.0497 0.0707
Brugia malayi Thioredoxin reductase 0.0048 0.0179 0.0391
Wolbachia endosymbiont of Brugia malayi leucyl aminopeptidase 0.0107 0.0497 0.0487
Echinococcus granulosus ankyrin repeat domain containing protein 17 0.0021 0.0036 0.0041
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.0029 0.005
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Giardia lamblia Sgs1 DNA helicase, putative 0.002 0.0029 1
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0023 0.0045 0.0091
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0035 0.0112 0.0394
Brugia malayi A-kinase anchor protein 10, precursor 0.0019 0.0026 0.0056
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0026 0.0027
Brugia malayi Aminopeptidase ZK353.6 in chromosome III 0.0021 0.0036 0.0078
Echinococcus granulosus intermediate filament protein 0.0027 0.0068 0.0088
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.1868 1 1
Treponema pallidum polypeptide deformylase (def) 0.1868 1 1
Onchocerca volvulus 0.024 0.1214 0.2774
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.1868 1 1
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0023 0.0045 0.0141
Onchocerca volvulus Matrix metalloproteinase homolog 0.0793 0.4198 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0193 0.0421
Trichomonas vaginalis DNA helicase recq, putative 0.002 0.0029 0.0156
Echinococcus multilocularis bloom syndrome protein 0.002 0.0029 0.0032
Schistosoma mansoni adenosine kinase 0.0087 0.0388 0.1439
Echinococcus multilocularis lamin 0.0027 0.0068 0.0088
Echinococcus multilocularis musashi 0.0027 0.0068 0.0088
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0026 0.007
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.1299 0.6932 1
Echinococcus multilocularis aminopeptidase N 0.012 0.0568 0.081
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Onchocerca volvulus 0.003 0.0084 0.0038
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0019 0.0026 0.0056
Loa Loa (eye worm) hypothetical protein 0.0357 0.185 0.4035
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0357 0.185 0.6957
Plasmodium falciparum peptide deformylase 0.1868 1 1
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0145 0.0701 0.2621
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Mycobacterium ulcerans peptide deformylase 0.1868 1 1
Onchocerca volvulus Matrilysin homolog 0.0357 0.185 0.4313
Onchocerca volvulus 0.0507 0.2655 0.6264
Loa Loa (eye worm) hypothetical protein 0.0357 0.185 0.4035
Echinococcus multilocularis subfamily M12B unassigned peptidase 0.0019 0.0022 0.0021
Schistosoma mansoni endothelin-converting enzyme-related 0.007 0.0298 0.1097
Loa Loa (eye worm) RGS-3 protein 0.0019 0.0026 0.0056
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0435 0.227 0.4952
Loa Loa (eye worm) hypothetical protein 0.0435 0.227 0.4952
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0048 0.0179 0.0169
Entamoeba histolytica recQ family helicase, putative 0.002 0.0029 0.0387
Brugia malayi hypothetical protein 0.0032 0.0096 0.021
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0121 0.0575 0.0565
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0026 0.0027
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0117 0.0159
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0068 0.0149
Echinococcus granulosus adam 0.0032 0.0096 0.0129
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0007 0.0016
Echinococcus granulosus expressed protein 0.0378 0.1958 0.2817
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0019 0.0026 0.0126
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0059 0.0128
Onchocerca volvulus 0.012 0.0568 0.121
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Schistosoma mansoni lamin 0.0027 0.0068 0.0231
Trypanosoma cruzi adenosine kinase, putative 0.0087 0.0388 0.1006
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0026 0.0027
Schistosoma mansoni PwLAP aminopeptidase (M17 family) 0.0021 0.0036 0.0108
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0084 0.029
Toxoplasma gondii hypothetical protein 0.1868 1 1
Trichomonas vaginalis set domain proteins, putative 0.024 0.1214 1
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0287 0.1467 0.5513
Mycobacterium ulcerans leucyl aminopeptidase 0.0107 0.0497 0.0487
Brugia malayi Aminopeptidase W07G4.4 in chromosome V 0.0021 0.0036 0.0078
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 0.0287 0.1467 0.3201
Loa Loa (eye worm) thioredoxin reductase 0.0048 0.0179 0.0391
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0035 0.0112 0.0839
Trypanosoma brucei Peptide deformylase 2 0.0713 0.3767 1
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Brugia malayi Matrixin family protein 0.0357 0.185 0.4035
Schistosoma mansoni DNA helicase recq5 0.002 0.0029 0.0083
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Toxoplasma gondii kinase, pfkB family protein 0.0087 0.0388 0.0378
Trypanosoma brucei Aminopeptidase M1, putative 0.0035 0.0112 0.0269
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0713 0.3767 1
Brugia malayi Matrixin family protein 0.0357 0.185 0.4035
Onchocerca volvulus 0.0243 0.1235 0.2824
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Echinococcus granulosus leucyl aminopeptidase 0.0021 0.0036 0.0041
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0059 0.0048
Brugia malayi Matrixin family protein 0.0357 0.185 0.4035
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0026 0.007
Echinococcus granulosus aminopeptidase N 0.012 0.0568 0.081
Schistosoma mansoni hypothetical protein 0.0171 0.0846 0.3167
Trichomonas vaginalis DNA helicase recq1, putative 0.002 0.0029 0.0156
Schistosoma mansoni thyroid hormone receptor 0.0138 0.0663 0.2477
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0019 0.0026 0.0056
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0011 0.0005
Schistosoma mansoni adam (A disintegrin and metalloprotease 0.0032 0.0096 0.0336
Brugia malayi glutathione reductase 0.0048 0.0179 0.0391
Toxoplasma gondii peptidase family M13 protein 0.0287 0.1467 0.1458
Echinococcus multilocularis adam 0.0032 0.0096 0.0129
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0713 0.3767 1
Entamoeba histolytica aminopeptidase, putative 0.0035 0.0112 0.9355
Brugia malayi hypothetical protein 0.0019 0.0026 0.0056
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Plasmodium vivax peptide deformylase, putative 0.1868 1 1
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 0.0287 0.1467 0.1458
Loa Loa (eye worm) peptidase family M13 containing protein 0.0212 0.1064 0.2321
Loa Loa (eye worm) hypothetical protein 0.002 0.0029 0.0064
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0084 0.0111
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0068 0.0149
Echinococcus multilocularis expressed protein 0.0378 0.1958 0.2817
Loa Loa (eye worm) hypothetical protein 0.0025 0.0059 0.0128
Loa Loa (eye worm) hypothetical protein 0.0087 0.0388 0.0847
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0109 0.051 0.05
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0026 0.0027
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.0084 0.0373 0.1381
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0011 0.0005
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0026 0.007
Loa Loa (eye worm) aminopeptidase in chromosome III 0.0021 0.0036 0.0078
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Onchocerca volvulus Matrilysin homolog 0.0793 0.4198 1
Schistosoma mansoni adenosine kinase 0.0087 0.0388 0.1439
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0019 0.0026 0.0027
Onchocerca volvulus 0.0357 0.185 0.4313
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Schistosoma mansoni thyroid hormone receptor 0.0138 0.0663 0.2477
Echinococcus granulosus subfamily M12B unassigned peptidase 0.0019 0.0022 0.0021
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0068 0.0149
Brugia malayi regulator of G-protein signaling egl-10 0.0019 0.0026 0.0056
Echinococcus granulosus adenosine kinase 0.0087 0.0388 0.055
Entamoeba histolytica hypothetical protein 0.0036 0.0117 1
Loa Loa (eye worm) hypothetical protein 0.0212 0.1064 0.2321
Schistosoma mansoni ADAMTS5 peptidase (M12 family) 0.0088 0.0397 0.1471
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0078 0.0102
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0059 0.0048
Plasmodium vivax glutathione reductase, putative 0.0048 0.0179 0.0169
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.0029 0.005
Trypanosoma brucei adenosine kinase, putative 0.0087 0.0388 0.1006
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0035 0.0112 0.0151
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0026 0.007
Loa Loa (eye worm) ATP-dependent DNA helicase 0.002 0.0029 0.0064
Loa Loa (eye worm) peptidase family M13 containing protein 0.0212 0.1064 0.2321
Toxoplasma gondii leucyl aminopeptidase LAP 0.0107 0.0497 0.0487
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0026 0.0027
Brugia malayi Peptidase family M1 containing protein 0.0035 0.0112 0.0243
Echinococcus multilocularis regulator of G protein signaling 3 0.0019 0.0026 0.0027
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0026 0.0056
Echinococcus granulosus geminin 0.0171 0.0846 0.1211
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.002 0.0029 0.0019
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0145 0.0701 0.2621
Schistosoma mansoni intermediate filament proteins 0.0027 0.0068 0.0231
Echinococcus multilocularis thyroid hormone receptor alpha 0.0138 0.0663 0.0947
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0011 0.0013
Schistosoma mansoni neprilysin-2 (M13 family) 0.0145 0.0701 0.2621
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0019 0.0026 0.007
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0127 0.0608 0.0868
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0019 0.0026 0.0056
Brugia malayi Pre-SET motif family protein 0.003 0.0084 0.0183
Brugia malayi regulator of G-protein signaling rgs-7 0.0019 0.0026 0.0056
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.002 0.0029 0.005
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Echinococcus granulosus Blood coagulation inhibitor Disintegrin 0.0117 0.0553 0.0788
Leishmania major cytosolic leucyl aminopeptidase,metallo-peptidase, Clan MF, Family M17 0.0107 0.0497 0.1295
Schistosoma mansoni z-protein (S1r protein) 0.0019 0.0026 0.007
Echinococcus granulosus axis inhibition protein axin 0.0019 0.0026 0.0027
Trypanosoma cruzi Aminopeptidase M1, putative 0.0035 0.0112 0.0269
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0026 0.007
Schistosoma mansoni Nep2 peptidase (M13 family) 0.0145 0.0701 0.2621
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0035 0.0112 0.0394
Mycobacterium ulcerans zinc metalloprotease 0.0287 0.1467 0.1458
Echinococcus multilocularis adam 17 protease 0.0187 0.0928 0.133
Mycobacterium leprae PROBABLE HYDROLASE 0.0435 0.227 0.1865
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Trypanosoma cruzi adenosine kinase, putative 0.0087 0.0388 0.1006
Brugia malayi Peptidase family M13 containing protein 0.0287 0.1467 0.3201
Brugia malayi hypothetical protein 0.0016 0.001 0.0022
Echinococcus multilocularis disintegrin and metalloproteinase 0.0019 0.0022 0.0021
Echinococcus granulosus a disintegrin and metalloproteinase with 0.0088 0.0397 0.0563
Brugia malayi cytosol aminopeptidase 0.0021 0.0036 0.0078
Trypanosoma cruzi Peptide deformylase 2, putative 0.0713 0.3767 1
Schistosoma mansoni dihydroceramide desaturase 0.0019 0.0022 0.0054
Trypanosoma brucei Polypeptide deformylase 1 0.0713 0.3767 1
Trypanosoma brucei adenosine kinase, putative 0.0087 0.0388 0.1006
Trypanosoma brucei Aminopeptidase M1, putative 0.0035 0.0112 0.0269
Loa Loa (eye worm) hypothetical protein 0.003 0.0084 0.0183
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.1299 0.6932 1
Schistosoma mansoni hypothetical protein 0.0127 0.0608 0.2269
Echinococcus multilocularis leucyl aminopeptidase 0.0021 0.0036 0.0041
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0019 0.0022 0.0054
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0035 0.0112 0.0839
Loa Loa (eye worm) hypothetical protein 0.0287 0.1467 0.3201
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.007 0.0298 0.1097
Schistosoma mansoni endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase) 0.007 0.0298 0.1097
Entamoeba histolytica hypothetical protein 0.0036 0.0117 1
Schistosoma mansoni hypothetical protein 0.0507 0.2655 1
Echinococcus multilocularis axis inhibition protein axin 0.0019 0.0026 0.0027
Brugia malayi hypothetical protein 0.0036 0.0117 0.0256
Mycobacterium ulcerans aminopeptidase N PepN 0.0035 0.0112 0.0101
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Mycobacterium tuberculosis Probable aminopeptidase PepB 0.0107 0.0497 0.0487
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0075 0.0325 0.1199
Schistosoma mansoni subfamily M12B unassigned peptidase (M12 family) 0.0019 0.0022 0.0054
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Onchocerca volvulus 0.0035 0.0112 0.0105
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0193 0.0421
Brugia malayi Bloom's syndrome protein homolog 0.002 0.0029 0.0064
Schistosoma mansoni hypothetical protein 0.0034 0.0107 0.0377
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Brugia malayi hypothetical protein 0.0019 0.0026 0.0056
Echinococcus multilocularis leucyl aminopeptidase 0.0021 0.0036 0.0041
Echinococcus granulosus leucyl aminopeptidase 0.0021 0.0036 0.0041
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0107 0.0497 0.1295
Entamoeba histolytica hypothetical protein 0.0036 0.0117 1
Brugia malayi Disintegrin family protein 0.0019 0.0022 0.0047
Brugia malayi Peptidase family M1 containing protein 0.012 0.0568 0.1239
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Loa Loa (eye worm) reprolysin 0.0019 0.0022 0.0047
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0026 0.007
Onchocerca volvulus 0.0142 0.0687 0.1498
Echinococcus granulosus disintegrin and metalloproteinase 0.0019 0.0022 0.0021
Brugia malayi intermediate filament protein 0.0027 0.0068 0.0149
Brugia malayi Pax transcription factor protein 2 0.0243 0.1235 0.2693
Loa Loa (eye worm) glutathione reductase 0.0048 0.0179 0.0391
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0145 0.0701 0.2621
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0026 0.0126
Chlamydia trachomatis cytosol aminopeptidase 0.0107 0.0497 0.0487
Schistosoma mansoni hypothetical protein 0.0171 0.0846 0.3167
Trypanosoma cruzi cytosolic leucyl aminopeptidase, putative 0.0107 0.0497 0.1295
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0084 0.0111
Loa Loa (eye worm) hypothetical protein 0.0019 0.0022 0.0047
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.002 0.0029 0.0019
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.021 0.1057 0.2306
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0035 0.0112 0.0269
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.002 0.0029 0.0032
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.002 0.0029 0.0032
Brugia malayi Matrixin family protein 0.0357 0.185 0.4035
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0084 0.029
Echinococcus granulosus Regulator of G protein signaling 20 0.0019 0.0026 0.0027
Echinococcus multilocularis a disintegrin and metalloproteinase with 0.0088 0.0397 0.0563
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Echinococcus granulosus adam 17 protease 0.0205 0.1029 0.1475
Loa Loa (eye worm) hypothetical protein 0.0212 0.1064 0.2321
Plasmodium vivax SET domain protein, putative 0.003 0.0084 0.0074
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0084 0.029
Plasmodium falciparum M17 leucyl aminopeptidase 0.0107 0.0497 0.0487
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.007 0.0298 0.1097
Trypanosoma brucei aminopeptidase, putative 0.0021 0.0036 0.0068
Trypanosoma cruzi metallo-peptidase, Clan MF, Family M17, putative 0.0107 0.0497 0.1295
Loa Loa (eye worm) PXA domain-containing protein 0.0019 0.0026 0.0056
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Trypanosoma brucei metallo-peptidase, Clan MF, Family M17 0.0021 0.0036 0.0068
Echinococcus multilocularis leucyl aminopeptidase 0.0021 0.0036 0.0041
Trypanosoma brucei trypanothione reductase 0.0048 0.0179 0.0449
Leishmania major adenosine kinase, putative 0.0087 0.0388 0.1006
Echinococcus multilocularis leucine aminopeptidase protein 0.0107 0.0497 0.0707
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0019 0.0026 0.0056
Trypanosoma cruzi aminopeptidase, putative 0.0035 0.0112 0.0269
Loa Loa (eye worm) RecQ helicase 0.002 0.0029 0.0064
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Loa Loa (eye worm) hypothetical protein 0.0217 0.1091 0.2379
Leishmania major polypeptide deformylase-like protein, putative 0.0713 0.3767 1
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0019 0.0026 0.007
Loa Loa (eye worm) hypothetical protein 0.0287 0.1467 0.3201
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0084 0.0111
Schistosoma mansoni leucine aminopeptidase 0.0021 0.0036 0.0108
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0107 0.0234
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0023 0.0045 0.0054
Trypanosoma cruzi Peptide deformylase 2, putative 0.0713 0.3767 1
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.002 0.0029 0.0064
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0059 0.0048
Brugia malayi peptidase family M13 containing protein 0.007 0.0298 0.065
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.1868 1 1
Echinococcus multilocularis adenosine kinase 0.0087 0.0388 0.055
Loa Loa (eye worm) hypothetical protein 0.0212 0.1064 0.2321
Brugia malayi PXA domain containing protein 0.0019 0.0026 0.0056
Schistosoma mansoni hypothetical protein 0.0036 0.0117 0.0416
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.007 0.0298 0.1097
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0026 0.0027
Schistosoma mansoni regulator of G protein signaling 0.0019 0.0026 0.007
Loa Loa (eye worm) hypothetical protein 0.0085 0.0378 0.0824
Mycobacterium tuberculosis Probable oxidoreductase 0.0121 0.0575 0.0565
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0084 0.0074
Echinococcus granulosus regulator of G protein signaling 3 0.0019 0.0026 0.0027
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0121 0.0575 0.0565
Loa Loa (eye worm) hypothetical protein 0.0023 0.0045 0.0097
Mycobacterium leprae probable zinc metalloprotease 0.0287 0.1467 0.1021
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Loa Loa (eye worm) aminopeptidase N 0.0035 0.0112 0.0243
Schistosoma mansoni hypothetical protein 0.0075 0.0325 0.1199
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0035 0.0112 0.0269
Echinococcus multilocularis geminin 0.0171 0.0846 0.1211
Loa Loa (eye worm) hypothetical protein 0.0034 0.0107 0.0234
Leishmania major trypanothione reductase 0.0048 0.0179 0.0449
Loa Loa (eye worm) hypothetical protein 0.0027 0.0068 0.0149
Loa Loa (eye worm) hypothetical protein 0.0212 0.1064 0.2321
Echinococcus granulosus beta-adrenergic receptor kinase 0.0019 0.0026 0.0027
Echinococcus multilocularis endothelin converting enzyme 1 0.0287 0.1467 0.2108
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0109 0.051 0.05
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0035 0.0112 0.0269
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0435 0.227 0.2262
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.002 0.0029 0.0019
Loa Loa (eye worm) hypothetical protein 0.0016 0.0007 0.0016
Echinococcus granulosus thioredoxin glutathione reductase 0.0048 0.0179 0.0248
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0109 0.051 0.05
Loa Loa (eye worm) hypothetical protein 0.0287 0.1467 0.3201
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.007 0.0298 0.1097
Echinococcus multilocularis regulator of G protein signaling 0.0019 0.0026 0.0027
Loa Loa (eye worm) hypothetical protein 0.0023 0.0045 0.0097
Toxoplasma gondii thioredoxin reductase 0.0048 0.0179 0.0169
Echinococcus multilocularis regulator of G protein signaling 7 0.0019 0.0026 0.0027
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0035 0.0112 0.0269
Brugia malayi Pre-SET motif family protein 0.021 0.1057 0.2306
Echinococcus granulosus lamin 0.0027 0.0068 0.0088
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0011 0.0023
Echinococcus multilocularis Blood coagulation inhibitor, Disintegrin 0.0117 0.0553 0.0788
Brugia malayi Adenosine kinase-like 0.0087 0.0388 0.0847
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0007 0.0016
Echinococcus granulosus ATP dependent DNA helicase Q1 0.002 0.0029 0.0032
Schistosoma mansoni axis inhibition protein axin 0.0019 0.0026 0.007
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0109 0.051 0.05
Brugia malayi PXA domain containing protein 0.0019 0.0026 0.0056
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0117 0.0416
Trypanosoma cruzi trypanothione reductase, putative 0.0048 0.0179 0.0449
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Plasmodium falciparum glutathione reductase 0.0048 0.0179 0.0169
Echinococcus granulosus endothelin converting enzyme 1 0.0287 0.1467 0.2108
Loa Loa (eye worm) aminopeptidase in chromosome V 0.0021 0.0036 0.0078
Schistosoma mansoni DNA helicase recq1 0.002 0.0029 0.0083
Schistosoma mansoni lamin 0.0027 0.0068 0.0231
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.0029 0.0019
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0127 0.0608 0.0868
Loa Loa (eye worm) matrixin family protein 0.0793 0.4198 0.9159
Loa Loa (eye worm) hypothetical protein 0.0019 0.0026 0.0056
Brugia malayi Hemopexin family protein 0.0507 0.2655 0.5793
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0121 0.0575 0.0082
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.002 0.0029 0.0064
Mycobacterium tuberculosis Probable reductase 0.0109 0.051 0.05
Loa Loa (eye worm) hypothetical protein 0.0392 0.2038 0.4446
Loa Loa (eye worm) pax transcription factor protein 2 0.0243 0.1235 0.2693
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0019 0.0026 0.0027
Echinococcus multilocularis beta adrenergic receptor kinase 0.0019 0.0026 0.0027
Leishmania major hypothetical protein, conserved 0.0025 0.0059 0.0128
Plasmodium vivax thioredoxin reductase, putative 0.0048 0.0179 0.0169
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0035 0.0112 0.0151
Loa Loa (eye worm) matrixin family protein 0.0864 0.4584 1
Echinococcus granulosus regulator of G protein signaling 7 0.0019 0.0026 0.0027
Mycobacterium tuberculosis Probable dehydrogenase 0.0109 0.051 0.05
Brugia malayi Regulator of G protein signaling domain containing protein 0.0019 0.0026 0.0056
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0021 0.0036 0.0078
Schistosoma mansoni serine/threonine protein kinase 0.0019 0.0026 0.007
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0007 0.0016
Echinococcus multilocularis thioredoxin glutathione reductase 0.0048 0.0179 0.0248
Loa Loa (eye worm) hypothetical protein 0.0357 0.185 0.4035
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0117 0.0159
Loa Loa (eye worm) peptidase family M1 containing protein 0.0097 0.0445 0.097
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.082 0.4346 0.6266
Echinococcus granulosus bloom syndrome protein 0.002 0.0029 0.0032
Plasmodium falciparum thioredoxin reductase 0.0048 0.0179 0.0169
Brugia malayi Matrixin family protein 0.0864 0.4584 1
Brugia malayi metalloprotease disintegrin 16 with thrombospondin type I motif 0.0088 0.0397 0.0866
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0059 0.0128
Echinococcus granulosus lamin dm0 0.0027 0.0068 0.0088
Schistosoma mansoni neprilysin 0.0075 0.0325 0.1199
Plasmodium vivax M17 leucyl aminopeptidase, putative 0.0107 0.0497 0.0487
Entamoeba histolytica hypothetical protein 0.0036 0.0117 1
Echinococcus granulosus ATP dependent DNA helicase Q5 0.002 0.0029 0.0032
Onchocerca volvulus 0.0077 0.0335 0.0646
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0193 0.0421
Loa Loa (eye worm) hypothetical protein 0.0107 0.0501 0.1093
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0109 0.051 0.0013
Loa Loa (eye worm) matrix metalloproteinase 0.0357 0.185 0.4035

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 0.05 nM Binding of 2-[125I]-iodomelatonin to membrane preparations of NIH3T3 cells stably expressing human Melatonin receptor type 1A ChEMBL. 14980664
Ki (binding) = 0.07 nM Binding of 2-[125I]-iodomelatonin to membrane preparations of NIH3T3 cells stably expressing human Melatonin receptor type 1B ChEMBL. 14980664
Ratio (binding) = 1.4 Selectivity ratio of Ki for MT1 melatonin receptor to that of MT2 melatonin receptor ChEMBL. 14980664

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.