Detailed information for compound 655318

Basic information

Technical information
  • TDR Targets ID: 655318
  • Name: 6-bromo-2-imino-N-(3-methylphenyl)chromene-3- carboxamide
  • MW: 357.201 | Formula: C17H13BrN2O2
  • H donors: 1 H acceptors: 1 LogP: 4.1 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cccc(c1)NC(=O)c1cc2cc(Br)ccc2oc1=N
  • InChi: 1S/C17H13BrN2O2/c1-10-3-2-4-13(7-10)20-17(21)14-9-11-8-12(18)5-6-15(11)22-16(14)19/h2-9,19H,1H3,(H,20,21)
  • InChiKey: XNUYWHJBEOGYKI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 6-bromo-2-imino-N-(3-methylphenyl)-3-chromenecarboxamide
  • Oprea1_195178

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
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0031 0.0985 0.1907
Trypanosoma brucei S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0031 0.0985 0.3033
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0452 0.1391
Schistosoma mansoni 5-methyl tetrahydrofolate-homocysteine methyltransferase reductase 0.0051 0.1846 0.5684
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0452 0.0452
Schistosoma mansoni phospholipase D 0.0049 0.1786 0.55
Brugia malayi FAD binding domain containing protein 0.0082 0.3247 1
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0082 0.3247 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0452 0.1391
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0031 0.0985 0.3033
Echinococcus granulosus NADPH cytochrome P450 reductase 0.0082 0.3247 1
Brugia malayi Phospholipase d protein 1 0.0049 0.1786 0.55
Loa Loa (eye worm) flavodoxin family protein 0.0031 0.0985 0.3033
Schistosoma mansoni NADPH flavin oxidoreductase 0.0041 0.1429 0.4402
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0452 0.0452
Treponema pallidum flavodoxin 0.0031 0.0985 1
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0452 0.1391
Entamoeba histolytica type A flavoprotein, putative 0.0031 0.0985 0.3997
Entamoeba histolytica type A flavoprotein, putative 0.0031 0.0985 0.3997
Loa Loa (eye worm) FAD binding domain-containing protein 0.0051 0.1846 0.5684
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.1214 0.2726
Mycobacterium leprae conserved hypothetical protein 0.0036 0.1214 0.5
Plasmodium falciparum NADPH--cytochrome P450 reductase, putative 0.0031 0.0985 0.3033
Leishmania major cytochrome P450 reductase, putative 0.0073 0.2831 0.8717
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0452 0.1391
Echinococcus granulosus dna polymerase eta 0.0019 0.0452 0.1391
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Mycobacterium ulcerans lipase LipD 0.0036 0.1214 0.3738
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.1214 0.3738
Entamoeba histolytica type A flavoprotein, putative 0.0031 0.0985 0.3997
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0182 0.0561
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0985 0.3033
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.1214 0.1214
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0452 0.1391
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1214 0.3738
Leishmania major hypothetical protein, conserved 0.0036 0.1214 0.3738
Echinococcus granulosus methionine synthase reductase 0.0051 0.1846 0.5684
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0452 0.1391
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.0082 0.3247 1
Mycobacterium ulcerans formate dehydrogenase H FdhF 0.0082 0.3247 1
Entamoeba histolytica phospholipase D, putative 0.0049 0.1786 1
Loa Loa (eye worm) FAD binding domain-containing protein 0.0082 0.3247 1
Echinococcus multilocularis methionine synthase reductase 0.0051 0.1846 0.5684
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Echinococcus granulosus phospholipase D 0.0044 0.1529 0.4708
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0452 0.1391
Entamoeba histolytica type A flavoprotein, putative 0.0031 0.0985 0.3997
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.1214 0.3738
Trypanosoma cruzi Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative 0.0031 0.0985 0.3033
Toxoplasma gondii ABC1 family protein 0.0036 0.1214 0.8661
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.1214 0.3738
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0452 0.1391
Trichomonas vaginalis esterase, putative 0.0036 0.1214 0.2726
Trypanosoma brucei unspecified product 0.0013 0.0182 0.0561
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.1214 0.2726
Trypanosoma cruzi p450 reductase, putative 0.0082 0.3247 1
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0452 0.1391
Echinococcus multilocularis phospholipase D 0.0044 0.1529 0.4708
Brugia malayi Phospholipase D. Active site motif family protein 0.0017 0.0352 0.1083
Plasmodium falciparum nitric oxide synthase, putative 0.0082 0.3247 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0182 0.0561
Giardia lamblia DINP protein human, muc B family 0.0019 0.0452 0.1596
Trypanosoma brucei NADPH-dependent diflavin oxidoreductase 1 0.0082 0.3247 1
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0082 0.3247 1
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.1214 0.3738
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.1214 0.2726
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0452 0.1391
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.1214 0.3738
Mycobacterium tuberculosis Conserved protein 0.0036 0.1214 0.1214
Leishmania major DNA polymerase eta, putative 0.0019 0.0452 0.1391
Brugia malayi flavodoxin family protein 0.0082 0.3247 1
Plasmodium vivax flavodoxin domain containing protein 0.0073 0.2831 0.8717
Leishmania major hypothetical protein, conserved 0.0031 0.0985 0.3033
Leishmania major DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.1214 0.2726
Giardia lamblia Hypothetical protein 0.0073 0.2831 1
Loa Loa (eye worm) hypothetical protein 0.0082 0.3247 1
Trypanosoma cruzi cardiolipin synthetase, putative 0.0017 0.0352 0.1083
Echinococcus granulosus dna polymerase kappa 0.0019 0.0452 0.1391
Chlamydia trachomatis sulfite reductase 0.0051 0.1846 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.1214 0.1214
Brugia malayi flavodoxin family protein 0.0031 0.0985 0.3033
Plasmodium vivax hypothetical protein, conserved 0.0036 0.1214 0.3738
Trypanosoma brucei DNA polymerase kappa, putative 0.0013 0.0182 0.0561
Trypanosoma brucei cardiolipin synthetase, putative 0.0017 0.0352 0.1083
Entamoeba histolytica type A flavoprotein, putative 0.0031 0.0985 0.3997
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Mycobacterium tuberculosis Conserved protein 0.0036 0.1214 0.1214
Trypanosoma brucei unspecified product 0.0013 0.0182 0.0561
Loa Loa (eye worm) hypothetical protein 0.0019 0.0452 0.1391
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0031 0.0985 0.1907
Echinococcus multilocularis dna polymerase eta 0.0019 0.0452 0.1391
Schistosoma mansoni DNA polymerase eta 0.0019 0.0452 0.1391
Mycobacterium ulcerans beta-lactamase 0.0036 0.1214 0.3738
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0031 0.0985 0.1907
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.1214 0.3738
Plasmodium falciparum S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative 0.0031 0.0985 0.3033
Onchocerca volvulus 0.0036 0.1214 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.1214 0.3738
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Echinococcus multilocularis phospholipase D1 0.0049 0.1786 0.55
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0452 0.1391
Mycobacterium ulcerans hypothetical protein 0.0036 0.1214 0.3738
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.1214 0.3738
Echinococcus granulosus phospholipase D1 0.0049 0.1786 0.55
Leishmania major p450 reductase, putative 0.0082 0.3247 1
Trypanosoma cruzi NADPH-dependent FMN/FAD containing oxidoreductase, putative 0.0082 0.3247 1
Toxoplasma gondii flavodoxin domain-containing protein 0.0041 0.1402 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.1214 0.1214
Loa Loa (eye worm) hypothetical protein 0.0032 0.1018 0.3134
Brugia malayi beta-lactamase family protein 0.0036 0.1214 0.3738
Onchocerca volvulus 0.0036 0.1214 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Loa Loa (eye worm) hypothetical protein 0.0041 0.1433 0.4414
Mycobacterium tuberculosis Conserved protein 0.0036 0.1214 0.1214
Toxoplasma gondii flavodoxin domain-containing protein 0.0041 0.1402 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Trypanosoma brucei unspecified product 0.0019 0.0452 0.1391
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.1214 0.1214
Trypanosoma cruzi cytochrome P450 reductase, putative 0.0082 0.3247 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Brugia malayi FAD binding domain containing protein 0.0051 0.1846 0.5684
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.1214 0.1214
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0452 0.1391
Onchocerca volvulus 0.0036 0.1214 1
Trichomonas vaginalis NADPH cytochrome P450, putative 0.0031 0.0985 0.1907
Schistosoma mansoni diflavin oxidoreductase 0.0041 0.1402 0.4316
Toxoplasma gondii phospholipase D active site domain-containing protein 0.0017 0.0352 0.2509
Trichomonas vaginalis NADPH fad oxidoreductase, putative 0.0073 0.2831 0.851
Giardia lamblia Nitric oxide synthase, inducible 0.0073 0.2831 1
Entamoeba histolytica phospholipase D, putative 0.0049 0.1786 1
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.1214 0.1214
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.1214 0.3738
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.1214 0.2726
Trichomonas vaginalis sulfite reductase, putative 0.0082 0.3247 1
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.0082 0.3247 1
Brugia malayi beta-lactamase 0.0036 0.1214 0.3738
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma cruzi NADPH--cytochrome P450 reductase, putative 0.0031 0.0985 0.3033
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.0082 0.3247 1
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma brucei NADPH--cytochrome P450 reductase, putative 0.0082 0.3247 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.1214 0.3738
Mycobacterium leprae Probable lipase LipE 0.0036 0.1214 0.5
Loa Loa (eye worm) hypothetical protein 0.0041 0.1433 0.4414
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma brucei cardiolipin synthetase 0.0017 0.0352 0.1083
Brugia malayi beta-lactamase family protein 0.0036 0.1214 0.3738
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.0082 0.3247 1
Trypanosoma brucei NADPH-cytochrome p450 reductase, putative 0.0082 0.3247 1
Trypanosoma cruzi cardiolipin synthetase, putative 0.0017 0.0352 0.1083
Schistosoma mansoni cytochrome P450 reductase 0.0082 0.3247 1
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.1214 0.1214
Loa Loa (eye worm) hypothetical protein 0.0036 0.1214 0.3738
Entamoeba histolytica phospholipase D active site domain-containing protein 0.0041 0.1433 0.7357
Loa Loa (eye worm) beta-lactamase 0.0036 0.1214 0.3738
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0452 0.1391
Loa Loa (eye worm) hypothetical protein 0.0032 0.1018 0.3134
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.0082 0.3247 1
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0452 0.1391

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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