Detailed information for compound 899893

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 362.354 | Formula: C21H15FN2O3
  • H donors: 2 H acceptors: 3 LogP: 4.37 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc2c(c1)nc(o2)c1cc(ccc1O)NC(=O)c1ccccc1F
  • InChi: 1S/C21H15FN2O3/c1-12-6-9-19-17(10-12)24-21(27-19)15-11-13(7-8-18(15)25)23-20(26)14-4-2-3-5-16(14)22/h2-11,25H,1H3,(H,23,26)
  • InChiKey: ODCALLISRCPMTB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Schistosoma mansoni transcription factor LCR-F1 0.0108 0.0208 0.0879
Brugia malayi Latrophilin receptor protein 2 0.0095 0.0155 0.0576
Toxoplasma gondii PAN domain-containing protein 0.0105 0.0196 0.0508
Loa Loa (eye worm) TK/ROR protein kinase 0.0306 0.1038 0.3861
Onchocerca volvulus 0.0105 0.0196 0.1077
Mycobacterium ulcerans hypothetical protein 0.0075 0.007 0.5
Loa Loa (eye worm) hypothetical protein 0.017 0.0467 0.1737
Onchocerca volvulus 0.0105 0.0196 0.1077
Echinococcus granulosus integrin alpha ps 0.0066 0.0033 0.0121
Onchocerca volvulus 0.0105 0.0196 0.1077
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0 0.5
Schistosoma mansoni survival motor neuron protein 0.0143 0.0354 0.1495
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) MH2 domain-containing protein 0.0243 0.0775 0.2881
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.0295
Brugia malayi Integrin alpha pat-2 precursor 0.0308 0.1045 0.3887
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) PAN domain-containing protein 0.0105 0.0196 0.0727
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) hypothetical protein 0.0242 0.0768 0.2856
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) integrin beta-2 0.063 0.2397 0.8915
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0075 0.007 0.0295
Brugia malayi hypothetical protein 0.0148 0.0375 0.1395
Entamoeba histolytica hypothetical protein 0.0108 0.0208 0.5
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0233 0.0731 0.2719
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0075 0.007 0.026
Toxoplasma gondii microneme protein MIC17C 0.0105 0.0196 0.0508
Echinococcus multilocularis Mastin 0.0075 0.007 0.007
Toxoplasma gondii PAN domain-containing protein 0.0978 0.3852 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.007 0.026
Loa Loa (eye worm) latrophilin receptor protein 2 0.0095 0.0155 0.0576
Schistosoma mansoni hypothetical protein 0.0095 0.0155 0.0654
Echinococcus granulosus Mastin 0.0075 0.007 0.026
Echinococcus granulosus snurportin 1 0.0623 0.2367 0.8802
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0143 0.0354 0.1316
Loa Loa (eye worm) PAN domain-containing protein 0.0105 0.0196 0.0727
Schistosoma mansoni hypothetical protein 0.0075 0.007 0.0295
Onchocerca volvulus 0.0306 0.1038 0.8298
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Echinococcus multilocularis integrin alpha 3 0.0236 0.0744 0.0744
Brugia malayi Protein kinase domain containing protein 0.0306 0.1038 0.3861
Leishmania major hypothetical protein, conserved 0.0306 0.1038 0.5
Loa Loa (eye worm) hypothetical protein 0.0075 0.007 0.026
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0095 0.0155 0.0576
Loa Loa (eye worm) hypothetical protein 0.0233 0.0731 0.2719
Echinococcus granulosus tissue type plasminogen activator 0.0306 0.1038 0.3861
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Onchocerca volvulus 0.0105 0.0196 0.1077
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0095 0.0155 0.0155
Echinococcus multilocularis integrin beta 2 0.0467 0.1713 0.1713
Schistosoma mansoni integrin alpha-ps 0.0072 0.0056 0.0238
Schistosoma mansoni hypothetical protein 0.0095 0.0155 0.0654
Echinococcus multilocularis glycoprotein Antigen 5 0.0075 0.007 0.007
Toxoplasma gondii microneme protein, putative 0.0105 0.0196 0.0508
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0108 0.0208 0.0774
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Schistosoma mansoni integrin alpha-ps 0.0138 0.0334 0.141
Onchocerca volvulus 0.0354 0.1237 1
Echinococcus multilocularis snurportin 1 0.0623 0.2367 0.2367
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0108 0.0208 0.0208
Echinococcus granulosus glycoprotein Antigen 5 0.0075 0.007 0.026
Toxoplasma gondii hypothetical protein 0.0105 0.0196 0.0508
Echinococcus granulosus transmembrane protease serine 3 0.0075 0.007 0.026
Loa Loa (eye worm) PAN domain-containing protein 0.0105 0.0196 0.0727
Schistosoma mansoni hypothetical protein 0.0066 0.0033 0.0138
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0623 0.2367 0.8802
Echinococcus multilocularis integrin alpha ps 0.0138 0.0334 0.0334
Loa Loa (eye worm) integrin alpha pat-2 0.0474 0.1744 0.6485
Schistosoma mansoni hypothetical protein 0.0623 0.2367 1
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Brugia malayi Trypsin family protein 0.0075 0.007 0.026
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Trypanosoma brucei importin beta-1 subunit, putative 0.0058 0 0.5
Echinococcus multilocularis tissue type plasminogen activator 0.0306 0.1038 0.1038
Onchocerca volvulus 0.0105 0.0196 0.1077
Trypanosoma cruzi hypothetical protein, conserved 0.0306 0.1038 0.5
Plasmodium falciparum cysteine repeat modular protein 1 0.0306 0.1038 1
Loa Loa (eye worm) hypothetical protein 0.0072 0.0056 0.021
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0354 0.1237 0.5226
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Brugia malayi Trypsin family protein 0.0354 0.1237 0.46
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Onchocerca volvulus 0.0105 0.0196 0.1077
Toxoplasma gondii microneme protein MIC4 0.0105 0.0196 0.0508
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Schistosoma mansoni hypothetical protein 0.0075 0.007 0.0295
Onchocerca volvulus 0.0105 0.0196 0.1077
Echinococcus granulosus integrin beta 2 0.0467 0.1713 0.6369
Toxoplasma gondii kringle domain-containing protein 0.0306 0.1038 0.2695
Toxoplasma gondii PAN domain-containing protein 0.0105 0.0196 0.0508
Schistosoma mansoni hypothetical protein 0.0095 0.0155 0.0654
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Onchocerca volvulus 0.0278 0.0922 0.7305
Onchocerca volvulus 0.0105 0.0196 0.1077
Toxoplasma gondii 1,3(4)-beta-glucanase 0.0105 0.0196 0.0508
Toxoplasma gondii hypothetical protein 0.0105 0.0196 0.0508
Loa Loa (eye worm) transcription factor SMAD2 0.0243 0.0775 0.2881
Loa Loa (eye worm) hypothetical protein 0.0301 0.1018 0.3785
Echinococcus granulosus enteropeptidase 0.0075 0.007 0.026
Loa Loa (eye worm) hypothetical protein 0.0066 0.0033 0.0121
Echinococcus granulosus GPCR family 2 0.0095 0.0155 0.0576
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0354 0.1237 0.5226
Toxoplasma gondii microneme protein MIC17A 0.0105 0.0196 0.0508
Echinococcus multilocularis transmembrane protease serine 3 0.0075 0.007 0.007
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0301 0.1018 0.3785
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Echinococcus multilocularis enteropeptidase 0.0075 0.007 0.007
Toxoplasma gondii PAN domain-containing protein 0.0978 0.3852 1
Echinococcus multilocularis integrin alpha ps 0.0138 0.0334 0.0334
Loa Loa (eye worm) hypothetical protein 0.0075 0.007 0.026
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Toxoplasma gondii subtilisin SUB12 0.0105 0.0196 0.0508
Schistosoma mansoni integrin beta subunit 0.0371 0.1311 0.5539
Brugia malayi Kelch motif family protein 0.0096 0.0157 0.0583
Brugia malayi hypothetical protein 0.0108 0.0208 0.0774
Brugia malayi hypothetical protein 0.0096 0.0157 0.0583
Echinococcus multilocularis geminin 0.0177 0.0498 0.0498
Onchocerca volvulus 0.0148 0.0375 0.2616
Brugia malayi Kringle domain containing protein 0.0306 0.1038 0.3861
Brugia malayi latrophilin 2 splice variant baaae 0.0206 0.0618 0.23
Onchocerca volvulus 0.0105 0.0196 0.1077
Echinococcus granulosus geminin 0.0177 0.0498 0.1852
Loa Loa (eye worm) hypothetical protein 0.0075 0.007 0.026
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0306 0.1038 1
Entamoeba histolytica hypothetical protein 0.0108 0.0208 0.5
Brugia malayi hypothetical protein 0.0075 0.007 0.026
Onchocerca volvulus 0.0143 0.0354 0.2432
Loa Loa (eye worm) hypothetical protein 0.07 0.2689 1
Loa Loa (eye worm) hypothetical protein 0.0206 0.0618 0.23
Loa Loa (eye worm) PAN domain-containing protein 0.0105 0.0196 0.0727
Toxoplasma gondii microneme protein MIC17B 0.0105 0.0196 0.0508
Loa Loa (eye worm) trypsin family protein 0.0075 0.007 0.026
Schistosoma mansoni hypothetical protein 0.0206 0.0618 0.2613
Schistosoma mansoni hypothetical protein 0.0095 0.0155 0.0654
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0301 0.1018 0.3785
Brugia malayi Trypsin family protein 0.0075 0.007 0.026
Schistosoma mansoni hypothetical protein 0.0143 0.0354 0.1495
Toxoplasma gondii PAN domain-containing protein 0.0105 0.0196 0.0508
Loa Loa (eye worm) hypothetical protein 0.0148 0.0375 0.1395
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Echinococcus granulosus integrin alpha ps 0.0138 0.0334 0.1241
Schistosoma mansoni hypothetical protein 0.0306 0.1038 0.4387
Loa Loa (eye worm) PAN domain-containing protein 0.0105 0.0196 0.0727
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.007
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.007 0.0295
Schistosoma mansoni hypothetical protein 0.0108 0.0208 0.0879
Brugia malayi Integrin beta pat-3 precursor 0.063 0.2397 0.8915
Brugia malayi PAN domain containing protein 0.0105 0.0196 0.0727
Schistosoma mansoni hypothetical protein 0.0177 0.0498 0.2104
Echinococcus multilocularis GPCR, family 2 0.0095 0.0155 0.0155
Echinococcus granulosus survival motor neuron protein 1 0.07 0.2689 1
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0075 0.007 0.026
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0075 0.007 0.007
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) hypothetical protein 0.0354 0.1237 0.46
Loa Loa (eye worm) hypothetical protein 0.0095 0.0155 0.0576
Schistosoma mansoni hypothetical protein 0.0177 0.0498 0.2104
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0095 0.0155 0.0155
Brugia malayi hypothetical protein 0.07 0.2689 1
Toxoplasma gondii PAN/Apple domain-containing protein 0.0105 0.0196 0.0508
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.0295
Toxoplasma gondii PAN domain-containing protein 0.0105 0.0196 0.0508
Brugia malayi Trypsin family protein 0.0075 0.007 0.026
Schistosoma mansoni integrin alpha 0.0308 0.1045 0.4416
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0095 0.0155 0.0576
Echinococcus granulosus integrin alpha 3 0.0236 0.0744 0.2767
Echinococcus multilocularis survival motor neuron protein 1 0.07 0.2689 0.2689
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.007 0.0295
Loa Loa (eye worm) hypothetical protein 0.0096 0.0157 0.0583
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0095 0.0155 0.0576
Onchocerca volvulus 0.0105 0.0196 0.1077
Loa Loa (eye worm) hypothetical protein 0.0306 0.1038 0.3861
Brugia malayi Calcitonin receptor-like protein seb-1 0.0301 0.1018 0.3785
Entamoeba histolytica hypothetical protein 0.0108 0.0208 0.5
Loa Loa (eye worm) hypothetical protein 0.0075 0.007 0.026
Entamoeba histolytica hypothetical protein 0.0108 0.0208 0.5
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0075 0.007 0.026
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0096 0.0157 0.0583
Brugia malayi MH2 domain containing protein 0.0243 0.0775 0.2881
Onchocerca volvulus 0.0105 0.0196 0.1077
Loa Loa (eye worm) hypothetical protein 0.0354 0.1237 0.46
Brugia malayi Trypsin-like protease protein 5 0.0075 0.007 0.026
Echinococcus multilocularis integrin alpha ps 0.0066 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.0105 0.0196 0.0727
Brugia malayi RNA, U transporter 1 0.0166 0.0451 0.1677

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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