Detailed information for compound 656129

Basic information

Technical information
  • TDR Targets ID: 656129
  • Name: 6-bromo-N-(2-fluorophenyl)-2-iminochromene-3- carboxamide
  • MW: 361.165 | Formula: C16H10BrFN2O2
  • H donors: 1 H acceptors: 1 LogP: 3.83 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc2c(c1)cc(c(=N)o2)C(=O)Nc1ccccc1F
  • InChi: 1S/C16H10BrFN2O2/c17-10-5-6-14-9(7-10)8-11(15(19)22-14)16(21)20-13-4-2-1-3-12(13)18/h1-8,19H,(H,20,21)
  • InChiKey: QDMDRFGJQHZGOT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-bromo-N-(2-fluorophenyl)-2-imino-chromene-3-carboxamide
  • 6-bromo-N-(2-fluorophenyl)-2-imino-3-chromenecarboxamide
  • Oprea1_678400

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
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.0072 0.0377 0.0377
Mycobacterium ulcerans beta-lactamase 0.0038 0.004 0.0015
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0146 0.0146
Mycobacterium leprae Probable lipase LipE 0.0038 0.004 0.004
Schistosoma mansoni adenosylhomocysteinase 0.065 0.6061 0.6061
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0055 0.0207 0.0207
Mycobacterium tuberculosis Probable adenosylhomocysteinase SahH (S-adenosyl-L-homocysteine hydrolase) (adohcyase) 0.105 1 1
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.105 1 1
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0055 0.0207 0.0207
Brugia malayi Glycosyl hydrolases family 31 protein 0.0173 0.1364 0.1364
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.0072 0.0377 0.0377
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0042 0.0042
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0055 0.0207 0.0207
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0038 0.004 0.004
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0146 0.0146
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0038 0.004 0.004
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0146 0.0146
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0055 0.0207 0.0207
Brugia malayi bHLH-PAS transcription factor 0.0037 0.0026 0.0026
Brugia malayi PAS domain containing protein 0.005 0.0152 0.0152
Toxoplasma gondii adenosylhomocysteinase, putative 0.105 1 1
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.0072 0.0377 0.0377
Schistosoma mansoni aryl hydrocarbon receptor 0.005 0.0152 0.0152
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0055 0.0207 0.0207
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.004 0.004
Trypanosoma cruzi S-adenosylhomocysteine hydrolase, putative 0.105 1 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0055 0.0207 0.0207
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0042 0.0042
Schistosoma mansoni adenosylhomocysteinase 0.065 0.6061 0.6061
Onchocerca volvulus 0.0038 0.004 0.0076
Toxoplasma gondii ABC1 family protein 0.0038 0.004 0.004
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.0042 0.0042
Plasmodium vivax adenosylhomocysteinase(S-adenosyl-L-homocystein e hydrolase), putative 0.105 1 1
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.0072 0.0377 0.0377
Brugia malayi beta-lactamase family protein 0.0038 0.004 0.004
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0055 0.0207 0.0207
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.0055 0.0207 0.8155
Schistosoma mansoni adenosylhomocysteinase 0.065 0.6061 0.6061
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0038 0.004 0.004
Mycobacterium tuberculosis Probable esterase LipL 0.0038 0.004 0.004
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.0055 0.0207 0.0207
Trypanosoma brucei S-adenosylhomocysteine hydrolase, putative 0.105 1 1
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Echinococcus multilocularis transfer RNA-Lys 0.0037 0.0026 0.0026
Trypanosoma brucei glucosidase, putative 0.0038 0.0042 0.0042
Echinococcus granulosus lysosomal alpha glucosidase 0.0173 0.1364 0.1364
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0042 0.0042
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0231 0.1939 0.1939
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0231 0.1939 0.1939
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.0072 0.0377 0.0377
Schistosoma mansoni alpha glucosidase 0.0038 0.0042 0.0042
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0038 0.004 0.004
Trichomonas vaginalis adenosylhomocysteinase, putative 0.105 1 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.006 0.0254 0.0254
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Schistosoma mansoni adenosylhomocysteinase 0.105 1 1
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0231 0.1939 0.1939
Entamoeba histolytica hypothetical protein 0.0055 0.0207 0.0207
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0055 0.0207 0.0207
Schistosoma mansoni phosphatidylinositol 4-kinase 0.006 0.0254 0.0254
Giardia lamblia Phosphatidylinositol 4-kinase 0.006 0.0254 1
Schistosoma mansoni alpha-glucosidase 0.0149 0.1127 0.1127
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0146 0.0146
Loa Loa (eye worm) beta-lactamase 0.0038 0.004 0.004
Mycobacterium ulcerans hypothetical protein 0.0038 0.004 0.0015
Loa Loa (eye worm) phosphatidylinositol 3 0.006 0.0254 0.0254
Plasmodium vivax phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.0055 0.0207 0.0207
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.006 0.0254 0.0254
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0072 0.0377 0.0377
Entamoeba histolytica adenosylhomocysteinase, putative 0.105 1 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Mycobacterium tuberculosis Probable lipase LipD 0.0038 0.004 0.004
Mycobacterium ulcerans esterase/lipase LipP 0.0038 0.004 0.0015
Mycobacterium leprae conserved hypothetical protein 0.0038 0.004 0.004
Mycobacterium tuberculosis Probable hydrolase 0.0038 0.004 0.004
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0055 0.0207 0.0207
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0231 0.1939 0.1939
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.004 0.004
Echinococcus granulosus single minded 2 0.0037 0.0026 0.0026
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Trichomonas vaginalis maltase-glucoamylase, putative 0.0038 0.0042 0.0042
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0231 0.1939 0.1939
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.0072 0.0377 0.0377
Mycobacterium tuberculosis Conserved protein 0.0038 0.004 0.004
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.004 0.004
Echinococcus granulosus adenosylhomocysteinase 0.105 1 1
Onchocerca volvulus 0.01 0.0647 0.325
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Brugia malayi hypoxia-induced factor 1 0.0153 0.1174 0.1174
Schistosoma mansoni single-minded 0.005 0.0152 0.0152
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0055 0.0207 0.0207
Trichomonas vaginalis adenosylhomocysteinase, putative 0.105 1 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0042 0.0042
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.0055 0.0207 0.0207
Trichomonas vaginalis sucrase-isomaltase, putative 0.0038 0.0042 0.0042
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.0042 0.0042
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.004 0.004
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0049 0.0146 0.0146
Echinococcus multilocularis lysosomal alpha glucosidase 0.0173 0.1364 0.1364
Brugia malayi hypothetical protein 0.0166 0.1301 0.1301
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0055 0.0207 0.0207
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0055 0.0207 0.0207
Onchocerca volvulus 0.0038 0.004 0.0076
Plasmodium falciparum phosphatidylinositol 3-kinase 0.0055 0.0207 0.0207
Loa Loa (eye worm) hypothetical protein 0.0166 0.1301 0.1301
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0038 0.004 0.0015
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0055 0.0207 0.0207
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.0042 0.0042
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Leishmania major S-adenosylhomocysteine hydrolase 0.105 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0231 0.1939 0.1939
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.0072 0.0377 0.0377
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0055 0.0207 0.0207
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0231 0.1939 0.1939
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0042 0.0042
Echinococcus multilocularis 0.006 0.0254 0.0254
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0146 0.0146
Loa Loa (eye worm) phosphatidylinositol 3 0.0231 0.1939 0.1939
Brugia malayi MH2 domain containing protein 0.0127 0.0919 0.0919
Mycobacterium ulcerans S-adenosyl-L-homocysteine hydrolase 0.105 1 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0173 0.1364 0.1364
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.0055 0.0207 0.0207
Onchocerca volvulus 0.0038 0.004 0.0076
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0051 0.0169 0.0169
Echinococcus multilocularis adenosylhomocysteinase 0.105 1 1
Plasmodium vivax hypothetical protein, conserved 0.0038 0.004 0.004
Loa Loa (eye worm) phosphatidylinositol kinase 0.0231 0.1939 0.1939
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0038 0.004 0.004
Schistosoma mansoni adenosylhomocysteinase 0.065 0.6061 0.6061
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.0055 0.0207 0.0207
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0042 0.0042
Loa Loa (eye worm) phosphatidylinositol 3 0.0055 0.0207 0.0207
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0042 0.0042
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0072 0.0377 0.0377
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.0042 0.0042
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0055 0.0207 0.0207
Loa Loa (eye worm) transcription factor SMAD2 0.0127 0.0919 0.0919
Brugia malayi beta-lactamase 0.0038 0.004 0.004
Trichomonas vaginalis penicillin-binding protein, putative 0.0038 0.004 0.004
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.006 0.0254 0.0254
Loa Loa (eye worm) hypoxia-induced factor 1 0.0153 0.1174 0.1174
Mycobacterium tuberculosis Probable lipase LipE 0.0038 0.004 0.004
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0055 0.0207 0.0207
Trichomonas vaginalis D-aminoacylase, putative 0.0038 0.004 0.004
Onchocerca volvulus 0.0231 0.1939 1
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0042 0.0042
Toxoplasma gondii S-Adenosyl homocysteine hydrolase 0.105 1 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0038 0.004 0.004
Trypanosoma brucei hypothetical protein, conserved 0.0038 0.004 0.004
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.0072 0.0377 0.0377
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0072 0.0377 0.0377
Loa Loa (eye worm) phosphatidylinositol 3 0.0231 0.1939 0.1939
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.006 0.0254 0.0254
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Leishmania major phosphatidylinositol 4-kinase, putative 0.006 0.0254 0.0254
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.0042 0.0042
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0231 0.1939 0.1939
Trichomonas vaginalis adenosylhomocysteinase, putative 0.033 0.2909 0.2909
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0146 0.0146
Mycobacterium leprae putative S-adenosyl-L-homocysteine hydrolase SahH 0.105 1 1
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.006 0.0254 0.0254
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.006 0.0254 0.0254
Mycobacterium tuberculosis Conserved protein 0.0038 0.004 0.004
Brugia malayi Glycosyl hydrolases family 31 protein 0.0038 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0038 0.004 0.004
Loa Loa (eye worm) adenosylhomocysteinase 0.105 1 1
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.0042 0.0042
Leishmania major hypothetical protein, conserved 0.0038 0.004 0.004
Trichomonas vaginalis esterase, putative 0.0038 0.004 0.004
Plasmodium falciparum adenosylhomocysteinase 0.105 1 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0055 0.0207 0.0207
Loa Loa (eye worm) MH2 domain-containing protein 0.0127 0.0919 0.0919
Mycobacterium tuberculosis Conserved protein 0.0038 0.004 0.004
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.0042 0.0042
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.004 0.004
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0055 0.0207 0.0207
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0244 0.2064 0.2064
Brugia malayi beta-lactamase family protein 0.0038 0.004 0.004
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.0081 0.0461 0.0461
Echinococcus granulosus beta LACTamase domain containing family member 0.0038 0.004 0.004
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.0055 0.0207 0.0207
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.0072 0.0377 0.0377
Schistosoma mansoni alpha-glucosidase 0.0149 0.1127 0.1127
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0173 0.1364 0.1364
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0055 0.0207 0.0207
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0049 0.0146 0.0146
Mycobacterium ulcerans lipase LipD 0.0038 0.004 0.0015
Echinococcus multilocularis Zinc finger, PHD finger 0.0055 0.0207 0.0207
Leishmania major phosphatidylinositol 3-kinase, putative 0.0055 0.0207 0.0207
Onchocerca volvulus 0.0231 0.1939 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0146 0.0146
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0038 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0055 0.0207 0.0207
Plasmodium falciparum phosphatidylinositol 4-kinase 0.006 0.0254 0.0254

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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