Detailed information for compound 804900

Basic information

Technical information
  • TDR Targets ID: 804900
  • Name: 3-[(2-bromophenyl)amino]-2-(furan-2-ylmethyl) -3H-isoindol-1-one
  • MW: 383.239 | Formula: C19H15BrN2O2
  • H donors: 1 H acceptors: 1 LogP: 4.05 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1c2ccccc2C(N1Cc1ccco1)Nc1ccccc1Br
  • InChi: 1S/C19H15BrN2O2/c20-16-9-3-4-10-17(16)21-18-14-7-1-2-8-15(14)19(23)22(18)12-13-6-5-11-24-13/h1-11,18,21H,12H2
  • InChiKey: RRKCAKSPFZJHGL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-[(2-bromophenyl)amino]-2-(2-furylmethyl)isoindolin-1-one
  • 3-[(2-bromophenyl)amino]-2-(2-furylmethyl)-1-isoindolinone

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
Giardia lamblia Kinase, CMGC MAPK 0.0051 0.0365 1
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.0064 0.0537 0.1183
Echinococcus multilocularis heat shock protein 90 0.0045 0.0293 0.0223
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0038 0.0195 0.0584
Schistosoma mansoni endoplasmin 0.0045 0.0293 0.0563
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0051 0.0365 0.6613
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Trypanosoma brucei protein kinase, putative 0.0051 0.0365 0.6613
Toxoplasma gondii transporter, major facilitator family protein 0.0028 0.0072 0.0159
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0052 0.0025
Loa Loa (eye worm) heat shock protein 90 0.0045 0.0293 0.0978
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Mycobacterium tuberculosis Probable carbon monoxyde dehydrogenase (medium chain) 0.0057 0.0449 0.5229
Loa Loa (eye worm) hypothetical protein 0.003 0.0089 0.0223
Echinococcus multilocularis chromobox protein 1 0.0067 0.0578 0.051
Echinococcus multilocularis chromobox protein 1 0.0067 0.0578 0.051
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0051 0.0365 0.6613
Onchocerca volvulus 0.0149 0.1644 0.7465
Loa Loa (eye worm) sodium-independent organic anion transporter 0.0028 0.0072 0.0159
Mycobacterium ulcerans carbon monoxyde dehydrogenase large chain CoxL 0.008 0.0743 0.618
Trypanosoma cruzi heat shock protein, putative 0.003 0.0096 0.1322
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Brugia malayi hypothetical protein 0.0049 0.0341 0.1154
Brugia malayi Heterochromatin protein 1 0.0067 0.0578 0.2032
Trypanosoma brucei heat shock protein 90, putative 0.0045 0.0293 0.5207
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.0365 0.1708
Brugia malayi MAP kinase sur-1 0.0051 0.0365 0.1242
Mycobacterium tuberculosis Probable carbon monoxyde dehydrogenase (large chain) 0.008 0.0743 1
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Trichomonas vaginalis chromobox protein, putative 0.0067 0.0578 0.2857
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0191 0.2178 0.3729
Mycobacterium ulcerans aerobic-type carbon monoxide dehydrogenase subunit CoxM_2 0.0057 0.0449 0.3502
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Schistosoma mansoni heat shock protein 0.0045 0.0293 0.0563
Leishmania major heat shock protein, putative 0.003 0.0096 0.1322
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0051 0.0365 0.1242
Echinococcus granulosus chromobox protein 1 0.0067 0.0578 0.0897
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0143 0.0421
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Mycobacterium ulcerans carbon monoxyde dehydrogenase medium chain CoxM 0.0057 0.0449 0.3502
Brugia malayi prostaglandin transporter 0.0028 0.0072 0.0159
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0191 0.2178 1
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Brugia malayi hypothetical protein 0.0028 0.0072 0.0159
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0195 0.0794
Brugia malayi hypothetical protein 0.0036 0.0167 0.0511
Plasmodium vivax heat shock protein 90, putative 0.003 0.0096 0.0353
Echinococcus granulosus heat shock protein 0.0045 0.0293 0.0392
Brugia malayi chromobox protein homolog 3 0.0038 0.0195 0.0614
Echinococcus granulosus geminin 0.0331 0.4003 0.696
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0043 0.0257 0.4496
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Echinococcus multilocularis neuropeptide receptor A26 0.0464 0.572 0.5689
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0043 0.0257 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0167 0.0168
Plasmodium falciparum heat shock protein 90, putative 0.0172 0.1933 1
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Schistosoma mansoni heat shock protein 0.003 0.0096 0.0061
Trypanosoma brucei heat shock protein 90, putative 0.0045 0.0293 0.5207
Echinococcus granulosus endoplasmin 0.0043 0.0257 0.0328
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.0064 0.0537 1
Entamoeba histolytica heat shock protein 90, putative 0.0045 0.0293 1
Brugia malayi hypothetical protein 0.0149 0.1644 0.5973
Loa Loa (eye worm) heterochromatin protein 1 0.0067 0.0578 0.2032
Schistosoma mansoni heat shock protein 0.0045 0.0293 0.0563
Trypanosoma brucei heat shock protein 84, putative 0.003 0.0096 0.1322
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Schistosoma mansoni hypothetical protein 0.0034 0.0143 0.018
Loa Loa (eye worm) prolyl oligopeptidase 0.0191 0.2178 0.7948
Echinococcus granulosus neuropeptide receptor A26 0.0464 0.572 1
Trypanosoma cruzi MFS transporter, putative 0.0028 0.0072 0.0847
Trichomonas vaginalis aldehyde oxidase, putative 0.017 0.1907 1
Mycobacterium ulcerans carbon monoxyde dehydrogenase large chain CoxL 0.005 0.0358 0.2678
Giardia lamblia Grp94/Hsp90 0.0043 0.0257 0.3122
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Onchocerca volvulus Heat shock protein 75 kDa, mitochondrial homolog 0.003 0.0096 0.0115
Echinococcus multilocularis neuropeptide s receptor 0.0464 0.572 0.5689
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Trypanosoma cruzi heat shock protein 85, putative 0.0045 0.0293 0.5207
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0051 0.0365 0.1241
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0345 0.1169
Entamoeba histolytica hypothetical protein 0.0036 0.0167 0.36
Schistosoma mansoni chromobox protein 0.0067 0.0578 0.1289
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Entamoeba histolytica hypothetical protein 0.0036 0.0167 0.36
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0195 0.0794
Mycobacterium ulcerans carbon monoxide dehydrogenase 0.0112 0.1163 1
Brugia malayi Endoplasmin precursor 0.0045 0.0293 0.0978
Echinococcus multilocularis mitogen activated protein kinase 3 0.0051 0.0365 0.0295
Loa Loa (eye worm) heat shock protein 75 0.003 0.0096 0.0248
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.003 0.0096 0.0043
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.0064 0.0537 1
Loa Loa (eye worm) endoplasmin 0.0045 0.0293 0.0978
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Toxoplasma gondii Hsp90 domain-containing protein 0.0172 0.1933 0.7037
Brugia malayi sodium-independent organic anion transporter family protein 0.0028 0.0072 0.0159
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0208 0.3535
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Treponema pallidum heat shock protein 90 0.0043 0.0257 1
Trichomonas vaginalis heat shock protein, putative 0.0043 0.0257 0.1129
Mycobacterium ulcerans carbon monoxyde dehydrogenase small chain CoxS 0.0032 0.0126 0.0568
Trypanosoma cruzi heat shock protein 85, putative 0.0045 0.0293 0.5207
Trichomonas vaginalis heat shock protein, putative 0.0033 0.0132 0.0457
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0051 0.0365 0.6613
Trichomonas vaginalis conserved hypothetical protein 0.0027 0.0052 0.0025
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.0365 0.1708
Schistosoma mansoni endoplasmin 0.0045 0.0293 0.0563
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Loa Loa (eye worm) hypothetical protein 0.0049 0.0341 0.1154
Toxoplasma gondii heat shock protein 90, putative 0.0045 0.0293 0.0977
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0191 0.2178 0.5358
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0043 0.0257 0.5
Trypanosoma cruzi Heat shock protein 83, putative 0.0045 0.0293 0.5207
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Entamoeba histolytica hypothetical protein 0.0036 0.0167 0.36
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.0064 0.0537 1
Echinococcus granulosus heat shock protein 90 0.0039 0.0208 0.0242
Loa Loa (eye worm) hypothetical protein 0.0034 0.0143 0.0421
Trichomonas vaginalis endoplasmin, putative 0.0033 0.0132 0.0457
Brugia malayi sodium-independent organic anion transporter family protein 0.0028 0.0072 0.0159
Onchocerca volvulus 0.003 0.0089 0.0082
Plasmodium falciparum heat shock protein 90, putative 0.0026 0.0047 0.0096
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0345 0.1169
Plasmodium vivax heat shock protein, putative 0.0172 0.1933 1
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.003 0.0096 0.0024
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Loa Loa (eye worm) transcription factor SMAD2 0.0233 0.2733 1
Entamoeba histolytica hypothetical protein 0.0036 0.0167 0.36
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0232 0.076
Trichomonas vaginalis heat shock protein, putative 0.0043 0.0257 0.1129
Toxoplasma gondii 1,3-beta-glucan synthase component protein 0.0234 0.2735 1
Schistosoma mansoni chromobox protein 0.0067 0.0578 0.1289
Trichomonas vaginalis chromobox protein, putative 0.0067 0.0578 0.2857
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Echinococcus multilocularis mitogen activated protein kinase 0.0051 0.0365 0.0295
Brugia malayi heat shock protein 90 0.0045 0.0293 0.0978
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.0064 0.0537 0.1877
Echinococcus granulosus mitogen activated protein kinase 3 0.0051 0.0365 0.0519
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0167 0.0096
Entamoeba histolytica heat shock protein 90, putative 0.0045 0.0293 1
Trypanosoma brucei heat shock protein, putative 0.0045 0.0293 0.5207
Echinococcus multilocularis heat shock protein 0.0045 0.0293 0.0223
Trypanosoma cruzi heat shock protein 90, putative 0.0039 0.0208 0.3535
Trypanosoma cruzi heat shock protein 85, putative 0.0045 0.0293 0.5207
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.0064 0.0537 1
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.0064 0.0537 1
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Loa Loa (eye worm) hypothetical protein 0.0149 0.1644 0.5973
Trichomonas vaginalis heat shock protein, putative 0.0045 0.0293 0.1324
Loa Loa (eye worm) MH2 domain-containing protein 0.0233 0.2733 1
Treponema pallidum quinoline 2-oxidoreductase 0.0027 0.0055 0.2133
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0039 0.0208 0.0242
Plasmodium vivax endoplasmin, putative 0.0045 0.0293 0.1389
Echinococcus granulosus mitogen activated protein kinase 0.0051 0.0365 0.0519
Echinococcus multilocularis heat shock protein 90 0.0039 0.0208 0.0138
Trichomonas vaginalis xanthine dehydrogenase, putative 0.017 0.1907 1
Brugia malayi prolyl oligopeptidase family protein 0.0191 0.2178 0.7948
Loa Loa (eye worm) hypothetical protein 0.0038 0.0195 0.0614
Giardia lamblia Heat shock protein HSP 90-alpha 0.0045 0.0293 0.5432
Echinococcus multilocularis geminin 0.0331 0.4003 0.3959
Plasmodium vivax heat shock protein 86, putative 0.0045 0.0293 0.1389
Echinococcus granulosus neuropeptide s receptor 0.0464 0.572 1
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0167 0.0242
Toxoplasma gondii heat shock protein 75, putative 0.003 0.0096 0.0248
Plasmodium falciparum heat shock protein 90 0.0045 0.0293 0.1389
Brugia malayi MH2 domain containing protein 0.0233 0.2733 1
Mycobacterium ulcerans carbon monoxyde dehydrogenase small chain CoxS 0.0032 0.0126 0.0568
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0051 0.0365 0.6613
Trichomonas vaginalis heat shock protein, putative 0.0039 0.0208 0.0867
Trichomonas vaginalis xanthine dehydrogenase, putative 0.017 0.1907 1
Echinococcus granulosus chromobox protein 1 0.0067 0.0578 0.0897
Schistosoma mansoni serine/threonine protein kinase 0.0051 0.0365 0.0745
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0043 0.0257 0.2129
Trypanosoma brucei Heat shock protein 83, putative 0.0045 0.0293 0.5207
Schistosoma mansoni hypothetical protein 0.0331 0.4003 1
Plasmodium falciparum endoplasmin, putative 0.0033 0.0132 0.0542
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0232 0.0994
Toxoplasma gondii heat shock protein HSP90 0.0045 0.0293 0.0977
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0051 0.0365 0.6613
Echinococcus granulosus heat shock protein 90 0.0045 0.0293 0.0392
Brugia malayi sodium-independent organic anion transporter family protein 0.0028 0.0072 0.0159
Mycobacterium ulcerans aerobic-type carbon monoxide dehydrogenase subunit CoxL_2 0.008 0.0743 0.618
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0232 0.0994
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0345 0.1169
Schistosoma mansoni hypothetical protein 0.0331 0.4003 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0051 0.0365 0.6613
Brugia malayi prolyl oligopeptidase family protein 0.0064 0.0537 0.1878
Echinococcus multilocularis endoplasmin 0.0043 0.0257 0.0187
Brugia malayi Hsp90 protein 0.003 0.0096 0.0248
Brugia malayi hypothetical protein 0.0028 0.0072 0.0159
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0191 0.2178 0.2121
Trypanosoma cruzi heat shock protein 90, putative 0.0045 0.0293 0.5207
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0051 0.0365 0.6613
Treponema pallidum hypothetical protein 0.0028 0.0063 0.2456
Mycobacterium ulcerans heat shock protein 90 0.0043 0.0257 0.1763
Leishmania major heat shock protein 83-1 0.0045 0.0293 0.5207
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.0365 0.1708
Echinococcus granulosus Dipeptidyl peptidase 9 0.0064 0.0537 0.0823
Schistosoma mansoni hypothetical protein 0.0036 0.0167 0.0242
Loa Loa (eye worm) hypothetical protein 0.0028 0.0072 0.0159
Trichomonas vaginalis CMGC family protein kinase 0.0051 0.0365 0.1708
Echinococcus multilocularis Dipeptidyl peptidase 9 0.0064 0.0537 0.0468
Loa Loa (eye worm) hypothetical protein 0.0049 0.0345 0.1169

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.
 
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

No literature references available for this target.

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