Detailed information for compound 974893

Basic information

Technical information
  • TDR Targets ID: 974893
  • Name: Oprea1_365850
  • MW: 289.328 | Formula: C19H15NO2
  • H donors: 1 H acceptors: 2 LogP: 2.55 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1NC(=O)C2C1C1c3ccccc3C2(c2c1cccc2)C
  • InChi: 1S/C19H15NO2/c1-19-12-8-4-2-6-10(12)14(11-7-3-5-9-13(11)19)15-16(19)18(22)20-17(15)21/h2-9,14-16H,1H3,(H,20,21,22)
  • InChiKey: SSDZGYRUDLCXBP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • BAS 01961912
  • Oprea1_710079

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
Loa Loa (eye worm) hypothetical protein 0.0013 0.0019 0.0066
Loa Loa (eye worm) hypothetical protein 0.0151 0.0675 0.231
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0074 0.2879
Echinococcus granulosus dnaJ subfamily B 0.0414 0.1931 0.6066
Entamoeba histolytica hypothetical protein 0.0035 0.0123 0.6589
Brugia malayi beta-lactamase 0.0038 0.0137 0.1219
Brugia malayi follicle stimulating hormone receptor 0.0226 0.1035 0.9784
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0623 0.2921 1
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.0137 0.0073
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0074 0.3382
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.022 0.9328
Mycobacterium ulcerans beta-lactamase 0.0038 0.0137 0.0073
Brugia malayi hypothetical protein 0.0025 0.0074 0.0618
Loa Loa (eye worm) hypothetical protein 0.0025 0.0074 0.0255
Brugia malayi Glycosyl hydrolases family 31 protein 0.0013 0.0019 0.0093
Echinococcus multilocularis dnaJ subfamily B 0.0414 0.1931 0.5174
Entamoeba histolytica hypothetical protein 0.0035 0.0123 0.6589
Brugia malayi Importin beta-1 subunit 0.0058 0.0235 0.2148
Schistosoma mansoni survival motor neuron protein 0.0047 0.0182 0.0542
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0253 0.0768
Mycobacterium tuberculosis Conserved protein 0.0038 0.0137 0.0073
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0096 0.0328
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.0137 0.0073
Echinococcus multilocularis snurportin 1 0.0623 0.2921 0.7828
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0137 0.7248
Plasmodium vivax hypothetical protein, conserved 0.0038 0.0137 0.5676
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.0074 0.2879
Trichomonas vaginalis maltase-glucoamylase, putative 0.0035 0.0124 0.6636
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0124 0.6636
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0043 0.0161 0.6744
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Leishmania major GTP-binding protein, putative 0.0043 0.0161 0.8795
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0182 0.1641
Loa Loa (eye worm) beta-lactamase 0.0038 0.0137 0.047
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.0137 0.0073
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0253 0.0679
Schistosoma mansoni cpg binding protein 0.0029 0.0096 0.0271
Brugia malayi beta-lactamase family protein 0.0038 0.0137 0.1219
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0047 0.0182 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0124 0.6636
Echinococcus multilocularis lysosomal alpha glucosidase 0.0158 0.071 0.1903
Brugia malayi hypothetical protein 0.0231 0.1058 1
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0065 0.0531
Loa Loa (eye worm) kap beta 3 protein 0.0011 0.001 0.0033
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0137 0.0403
Onchocerca volvulus 0.0038 0.0137 0.3164
Onchocerca volvulus 0.0049 0.0191 0.4602
Mycobacterium tuberculosis Conserved protein 0.0038 0.0137 0.0073
Entamoeba histolytica hypothetical protein 0.0035 0.0123 0.6589
Schistosoma mansoni alpha glucosidase 0.0035 0.0124 0.0361
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.0137 0.0073
Echinococcus multilocularis transportin 1 0.0011 0.001 0.0026
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0.0235 1
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.0137 0.5676
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.0137 0.0403
Echinococcus granulosus translational activator gcn1 0.0011 0.001 0.003
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0124 0.6636
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0253 0.0768
Onchocerca volvulus 0.0038 0.0137 0.3164
Echinococcus multilocularis microtubule associated protein 2 0.0677 0.3182 0.8529
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0065 0.3222
Brugia malayi TAR-binding protein 0.0062 0.0253 0.2324
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.0137 0.0073
Schistosoma mansoni microtubule-associated protein tau 0.0677 0.3182 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0065 0.0223
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0043 0.0161 0.0433
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.0137 0.0368
Trichomonas vaginalis sucrase-isomaltase, putative 0.0035 0.0124 0.6636
Trichomonas vaginalis ran, putative 0.0043 0.0161 0.8795
Brugia malayi RNA, U transporter 1 0.0166 0.0747 0.7032
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0074 0.2879
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0.0235 1
Mycobacterium tuberculosis Probable histidinol dehydrogenase HisD (HDH) 0.2109 1 1
Schistosoma mansoni hypothetical protein 0.0035 0.0123 0.0358
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0124 0.6636
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.001 0.0031
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0242 0.1109 0.1051
Echinococcus multilocularis importin 5 0.0011 0.001 0.0026
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0123 0.0331
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0043 0.0161 1
Toxoplasma gondii exonuclease III APE 0.0023 0.0065 0.2471
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0253 0.0768
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0043 0.0161 0.6744
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0158 0.071 0.2431
Brugia malayi Glycosyl hydrolases family 31 protein 0.0158 0.071 0.6682
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0137 0.7403
Loa Loa (eye worm) RNA binding protein 0.0062 0.0253 0.0867
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0013 0.0019 0.0562
Echinococcus granulosus importin 5 0.0011 0.001 0.003
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0137 0.7403
Loa Loa (eye worm) hypothetical protein 0.0058 0.0235 0.0804
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0074 0.3382
Echinococcus granulosus tar DNA binding protein 0.0062 0.0253 0.0796
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0065 0.2818
Entamoeba histolytica Ran family GTPase 0.0043 0.0161 0.8795
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0226 0.1035 0.3544
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0137 0.7248
Mycobacterium tuberculosis Conserved protein 0.0038 0.0137 0.0073
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.0137 0.0073
Plasmodium vivax importin-beta 2, putative 0.0058 0.0235 1
Echinococcus granulosus transportin 1 0.0011 0.001 0.003
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0035 0.0124 0.5088
Schistosoma mansoni importin beta-1 0.0058 0.0235 0.071
Toxoplasma gondii ABC1 family protein 0.0038 0.0137 0.5676
Trypanosoma brucei glycosyl hydrolase-like protein 0.0013 0.0019 0.0431
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0065 0.3222
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0019 0.0562
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0253 0.0768
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0124 0.6636
Brugia malayi hypothetical protein 0.0016 0.0033 0.0222
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0124 0.6636
Loa Loa (eye worm) importin-beta domain-containing protein 0.0011 0.001 0.0033
Echinococcus multilocularis lysosomal alpha glucosidase 0.0158 0.071 0.1903
Loa Loa (eye worm) hypothetical protein 0.0151 0.0675 0.231
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0035 0.0124 0.0425
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0161 0.8724
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0019 0.0562
Schistosoma mansoni alpha-glucosidase 0.0136 0.0605 0.1877
Echinococcus multilocularis neutral alpha glucosidase AB 0.0035 0.0124 0.0333
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0074 0.2879
Mycobacterium ulcerans histidinol dehydrogenase 0.2109 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0124 0.6435
Loa Loa (eye worm) hypothetical protein 0.0038 0.0137 0.047
Brugia malayi RNA binding protein 0.0062 0.0253 0.2324
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0137 0.7403
Brugia malayi CXXC zinc finger family protein 0.0029 0.0096 0.0821
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0253 0.0768
Trichomonas vaginalis esterase, putative 0.0038 0.0137 0.7403
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0065 0.2471
Entamoeba histolytica hypothetical protein 0.0035 0.0123 0.6589
Loa Loa (eye worm) hypothetical protein 0.0231 0.1058 0.3621
Schistosoma mansoni hypothetical protein 0.0623 0.2921 0.9176
Echinococcus multilocularis cpg binding protein 0.0031 0.0104 0.0278
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0793 0.3731 1
Toxoplasma gondii HEAT repeat-containing protein 0.0058 0.0235 1
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0124 0.6435
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0013 0.0019 0.0562
Echinococcus multilocularis muscleblind protein 1 0.0151 0.0675 0.1808
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0019 0.0562
Trichomonas vaginalis alpha-glucosidase, putative 0.0035 0.0124 0.6636
Schistosoma mansoni ap endonuclease 0.0023 0.0065 0.0175
Trypanosoma brucei glucosidase, putative 0.0035 0.0124 0.5088
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0065 0.0205
Echinococcus granulosus lysosomal alpha glucosidase 0.0158 0.071 0.2231
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.1058 0.2835
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0065 0.3222
Plasmodium falciparum importin beta, putative 0.0058 0.0235 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0013 0.0019 0.0562
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0043 0.0161 0.6744
Loa Loa (eye worm) hypothetical protein 0.0049 0.0191 0.0654
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0074 0.2879
Schistosoma mansoni ran 0.0043 0.0161 0.0479
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0043 0.0161 0.1449
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.0137 0.0432
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0035 0.0124 0.6636
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.0137 0.7403
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0253 0.0867
Leishmania major hypothetical protein, conserved 0.0038 0.0137 0.7403
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0253 0.2324
Echinococcus multilocularis tumor protein p63 0.0336 0.1556 0.4169
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0065 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0019 0.0562
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0065 0.5
Trypanosoma cruzi importin beta-1 subunit, putative 0.0047 0.0182 1
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0043 0.0161 0.8724
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0065 0.0175
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0065 0.2471
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.0137 0.047
Leishmania major alpha glucosidase II subunit, putative 0.0035 0.0124 0.6636
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0123 0.0358
Brugia malayi Muscleblind-like protein 0.0151 0.0675 0.6346
Echinococcus multilocularis translational activator gcn1 0.0011 0.001 0.0026
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0047 0.0182 1
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.1058 0.3324
Echinococcus granulosus neutral alpha glucosidase AB 0.0035 0.0124 0.039
Schistosoma mansoni ran 0.0043 0.0161 0.0479
Echinococcus granulosus importin subunit beta 1 0.0058 0.0235 0.0738
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0123 0.0388
Schistosoma mansoni cpg binding protein 0.0031 0.0104 0.0296
Echinococcus granulosus muscleblind protein 0.0151 0.0675 0.212
Onchocerca volvulus 0.0029 0.0096 0.2046
Echinococcus granulosus snurportin 1 0.0623 0.2921 0.9179
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.001 0.0026
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.0137 0.7403
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.0137 0.0073
Echinococcus granulosus cpg binding protein 0.0031 0.0104 0.0326
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.0137 0.0073
Leishmania major importin beta-1 subunit, putative 0.0047 0.0182 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.0137 0.0073
Echinococcus granulosus microtubule associated protein 2 0.0677 0.3182 1
Entamoeba histolytica hypothetical protein 0.0047 0.0182 1
Brugia malayi hypothetical protein 0.0035 0.0123 0.1085
Trichomonas vaginalis maltase-glucoamylase, putative 0.0013 0.0019 0.0562
Brugia malayi beta-lactamase family protein 0.0038 0.0137 0.1219
Leishmania major glycosyl hydrolase-like protein 0.0013 0.0019 0.0562
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0065 0.3222
Schistosoma mansoni hypothetical protein 0.0047 0.0182 0.0542
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.0251 0.0761
Schistosoma mansoni ap endonuclease 0.0023 0.0065 0.0175
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0065 0.2471
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0035 0.0124 0.6636
Schistosoma mansoni hypothetical protein 0.0414 0.1931 0.6054
Brugia malayi Glycosyl hydrolases family 31 protein 0.0035 0.0124 0.1093
Schistosoma mansoni cpg binding protein 0.0031 0.0104 0.0296
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0043 0.0161 0.0553
Onchocerca volvulus 0.0047 0.0182 0.4348
Echinococcus multilocularis muscleblind protein 0.0151 0.0675 0.1808
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.0137 0.1219
Onchocerca volvulus 0.0038 0.0137 0.3164
Mycobacterium ulcerans hypothetical protein 0.0038 0.0137 0.0073
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0253 0.0867
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0065 0.2818
Schistosoma mansoni alpha-glucosidase 0.0136 0.0605 0.1877
Onchocerca volvulus 0.0091 0.0393 1
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0043 0.0161 0.6744
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.0191 0.0572
Leishmania major hypothetical protein, conserved 0.0025 0.0074 0.3754
Echinococcus granulosus GTP binding nuclear protein Ran 0.0043 0.0161 0.0507
Echinococcus multilocularis importin subunit beta 1 0.0058 0.0235 0.0629
Trichomonas vaginalis alpha-glucosidase, putative 0.0013 0.0019 0.0562
Mycobacterium ulcerans lipase LipD 0.0038 0.0137 0.0073
Trichomonas vaginalis importin beta-1, putative 0.0047 0.0182 1
Echinococcus granulosus tumor protein p63 0.0336 0.1556 0.4888

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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