Detailed information for compound 815576

Basic information

Technical information
  • TDR Targets ID: 815576
  • Name: 4-chloro-N-(1-propylbenzimidazol-2-yl)benzami de
  • MW: 313.781 | Formula: C17H16ClN3O
  • H donors: 1 H acceptors: 2 LogP: 4.06 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCn1c(NC(=O)c2ccc(cc2)Cl)nc2c1cccc2
  • InChi: 1S/C17H16ClN3O/c1-2-11-21-15-6-4-3-5-14(15)19-17(21)20-16(22)12-7-9-13(18)10-8-12/h3-10H,2,11H2,1H3,(H,19,20,22)
  • InChiKey: HLHBUYSGKVXMOP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-chloro-N-(1-propyl-2-benzimidazolyl)benzamide
  • BIM-0007759.P001
  • CBMicro_007979
  • Oprea1_334578
  • ZINC00448012
  • STK013194

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
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0513 0.0114
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0513 0.0039
Plasmodium falciparum plasmepsin VI 0.0108 0.2415 0.3023
Schistosoma mansoni hypothetical protein 0.0036 0.0506 0.0106
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0039 0.0601 1
Toxoplasma gondii aspartyl protease 0.0052 0.0948 0.0989
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.2129 0.2033
Plasmodium vivax aspartyl proteinase, putative 0.0052 0.0948 0.0989
Leishmania major hypothetical protein, conserved 0.0036 0.0513 0.7597
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0513 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0601 0.0156
Brugia malayi beta-lactamase family protein 0.0036 0.0513 0.0852
Loa Loa (eye worm) hypothetical protein 0.0108 0.2415 0.3772
Schistosoma mansoni cathepsin D (A01 family) 0.0397 1 1
Plasmodium falciparum plasmepsin III 0.0052 0.0948 0.0989
Brugia malayi hypothetical protein 0.0122 0.2769 0.4604
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0097 0.2129 0.354
Onchocerca volvulus Huntingtin homolog 0.0122 0.2769 0.4108
Loa Loa (eye worm) hypothetical protein 0.0052 0.0948 0.1235
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.2129 0.2004
Loa Loa (eye worm) aspartyl protease 6 0.0052 0.0948 0.1235
Loa Loa (eye worm) hypothetical protein 0.0122 0.2769 0.4385
Schistosoma mansoni memapsin-2 (A01 family) 0.0052 0.0948 0.0567
Brugia malayi aspartic protease BmAsp-2, identical 0.0052 0.0948 0.1576
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Toxoplasma gondii aspartyl protease ASP1 0.0108 0.2415 0.3023
Brugia malayi hypothetical protein 0.0052 0.0948 0.1576
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0506 0.0106
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Brugia malayi hypothetical protein 0.0052 0.0948 0.1576
Loa Loa (eye worm) hypothetical protein 0.0052 0.0948 0.1235
Plasmodium falciparum plasmepsin X 0.03 0.7448 1
Brugia malayi beta-lactamase family protein 0.0036 0.0513 0.0852
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0506 0.0154
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0404 0.0035
Loa Loa (eye worm) beta-lactamase 0.0036 0.0513 0.0482
Toxoplasma gondii ABC1 family protein 0.0036 0.0513 0.0386
Echinococcus granulosus cathepsin d lysosomal aspartyl protease 0.0108 0.2415 0.2363
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0513 0.0127
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase 0.0108 0.2415 0.3367
Plasmodium vivax aspartyl protease, putative 0.03 0.7448 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0404 0.0235
Onchocerca volvulus Huntingtin homolog 0.0122 0.2769 0.4108
Loa Loa (eye worm) hypothetical protein 0.0122 0.2769 0.4385
Schistosoma mansoni inositol monophosphatase 0.0039 0.0601 0.0205
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0513 0.0852
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Echinococcus multilocularis inositol monophosphatase 1 0.0039 0.0601 0.0229
Brugia malayi Inositol-1 0.0039 0.0601 0.0999
Plasmodium falciparum plasmepsin I 0.0108 0.2415 0.3023
Plasmodium vivax aspartyl protease, putative 0.0052 0.0948 0.0989
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0097 0.2129 0.3278
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0601 1
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0108 0.2415 0.3772
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) 0.0108 0.2415 0.2336
Schistosoma mansoni hypothetical protein 0.036 0.9013 0.8972
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0601 1
Schistosoma mansoni hypothetical protein 0.036 0.9013 0.8972
Plasmodium falciparum plasmepsin IV 0.0108 0.2415 0.3023
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.2129 0.1798
Brugia malayi Pepsin A precursor 0.0052 0.0948 0.1576
Mycobacterium tuberculosis Conserved protein 0.0036 0.0513 0.0039
Plasmodium falciparum plasmepsin IX 0.03 0.7448 1
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0513 0.0039
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0513 0.0386
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0221 0.5362 0.887
Brugia malayi Eukaryotic aspartyl protease family protein 0.0052 0.0948 0.1576
Echinococcus granulosus geminin 0.036 0.9013 1
Echinococcus multilocularis geminin 0.036 0.9013 1
Plasmodium vivax aspartyl protease, putative 0.03 0.7448 1
Mycobacterium leprae Probable lipase LipE 0.0036 0.0513 1
Onchocerca volvulus 0.0251 0.6162 1
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0513 0.7597
Echinococcus granulosus inositol monophosphatase 1 0.0039 0.0601 0.0263
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0039 0.0601 0.0156
Brugia malayi aspartic protease BmAsp-1, identical 0.0052 0.0948 0.1576
Mycobacterium tuberculosis Conserved protein 0.0036 0.0513 0.0039
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0108 0.2415 0.2096
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0513 0.7597
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Plasmodium vivax plasmepsin IV, putative 0.0108 0.2415 0.3023
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0513 0.7597
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0246 0.6015 1
Plasmodium falciparum plasmepsin VIII, putative 0.0052 0.0948 0.0989
Plasmodium falciparum plasmepsin VII 0.0052 0.0948 0.0989
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0513 0.0039
Onchocerca volvulus 0.0036 0.0513 0.0189
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.2129 0.1798
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0513 0.0161
Plasmodium vivax aspartyl proteinase, putative 0.0108 0.2415 0.3023
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0039 0.0601 1
Plasmodium falciparum plasmepsin V 0.0052 0.0948 0.0989
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0039 0.0601 0.0508
Brugia malayi beta-lactamase 0.0036 0.0513 0.0852
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0513 0.0114
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0513 0.0039
Trichomonas vaginalis set domain proteins, putative 0.0251 0.6162 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Brugia malayi follicle stimulating hormone receptor 0.0246 0.6015 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.2129 0.2004
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0513 0.0482
Schistosoma mansoni inositol monophosphatase 0.0039 0.0601 0.0205
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0513 0.0039
Mycobacterium tuberculosis Conserved protein 0.0036 0.0513 0.0039
Loa Loa (eye worm) hypothetical protein 0.0032 0.0404 0.0293
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0601 1
Plasmodium falciparum plasmepsin II 0.0108 0.2415 0.3023
Onchocerca volvulus 0.0052 0.0948 0.0945
Toxoplasma gondii eukaryotic aspartyl protease superfamily protein 0.0052 0.0948 0.0989
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Toxoplasma gondii aspartyl protease ASP3 0.03 0.7448 1
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0513 0.0039
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0506 0.0119
Brugia malayi Pre-SET motif family protein 0.0221 0.5362 0.8914
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0039 0.0601 0.5
Onchocerca volvulus 0.0036 0.0513 0.0189
Loa Loa (eye worm) inositol-1 0.0039 0.0601 0.0634
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.2129 0.2033
Loa Loa (eye worm) aspartic protease BmAsp-1 0.0052 0.0948 0.1235
Loa Loa (eye worm) hypothetical protein 0.0036 0.0513 0.0482
Brugia malayi Pre-SET motif family protein 0.0032 0.0404 0.0671
Onchocerca volvulus 0.0052 0.0948 0.0945
Brugia malayi hypothetical protein 0.0025 0.0234 0.0389
Onchocerca volvulus 0.0036 0.0513 0.0189
Trichomonas vaginalis inositol monophosphatase, putative 0.0039 0.0601 0.0156
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0039 0.0601 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.2129 0.1798
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0229 0.5574 1
Plasmodium vivax SET domain protein, putative 0.0032 0.0404 0.0235
Brugia malayi hypothetical protein 0.0036 0.0506 0.0841
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0108 0.2415 0.3023
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0513 0.0039
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0052 0.0948 0.0567
Plasmodium vivax plasmepsin V, putative 0.0052 0.0948 0.0989

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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