Detailed information for compound 1629178

Basic information

Technical information
  • TDR Targets ID: 1629178
  • Name: 5-chloro-8-methyl-2-phenyl-1H-quinolin-4-one
  • MW: 269.726 | Formula: C16H12ClNO
  • H donors: 1 H acceptors: 1 LogP: 4.19 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(c2c1[nH]c(cc2=O)c1ccccc1)Cl
  • InChi: 1S/C16H12ClNO/c1-10-7-8-12(17)15-14(19)9-13(18-16(10)15)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,19)
  • InChiKey: WQTDDEJDGYOWAZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-chloro-8-methyl-2-phenyl-4-quinolone
  • NSC656248
  • NCI60_019464

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
Loa Loa (eye worm) hypothetical protein 0.007 0.2466 0.2817
Entamoeba histolytica hypothetical protein 0.0084 0.337 0.432
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.007 0.2466 0.2933
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0041 0.0552 0.078
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 0.0187 1 1
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0114 0.5249 0.72
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.0083 0.3311 0.4229
Trichomonas vaginalis PIKK family atypical protein kinase 0.0086 0.3468 0.4901
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.1117 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.1117 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0516 0.0729
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.0187 1 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0051 0.1218 0.102
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.1117 0.1579
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0114 0.5249 0.6934
Trypanosoma brucei phosphatidylinositol 3-related kinase, putative 0.0049 0.1117 0.0866
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.007 0.2466 0.1518
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0074 0.2705 0.3822
Trichomonas vaginalis PIKK family atypical protein kinase 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0085 0.3415 0.4826
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2944 0.4161
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2952 0.4171
Trichomonas vaginalis PIKK family atypical protein kinase 0.0086 0.3468 0.4901
Trichomonas vaginalis PIKK family atypical protein kinase 0.0142 0.7076 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0142 0.7076 1
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0142 0.7076 1
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0061 0.1835 0.1966
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0142 0.7076 1
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0113 0.5242 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.0096 0.4125 0.5829
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2944 0.4161
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.1117 0.1579
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0041 0.0552 0.078
Trichomonas vaginalis PIKK family atypical protein kinase 0.0113 0.5242 0.7408
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0104 0.4618 0.6232
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2952 0.4171
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0142 0.7076 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0104 0.4618 0.6232
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0049 0.1117 0.0598
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.0074 0.2705 0.3822
Trichomonas vaginalis PIKK family atypical protein kinase 0.0113 0.5242 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0142 0.7076 0.6709
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0113 0.5242 0.7408
Trichomonas vaginalis PIKK family atypical protein kinase 0.0093 0.3931 0.5555
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.0104 0.4618 0.6526
Trypanosoma cruzi target of rapamycin kinase 3 0.0114 0.5249 0.72
Loa Loa (eye worm) phosphatidylinositol 3 0.0049 0.1117 0.1277
Loa Loa (eye worm) hypothetical protein 0.0033 0.0082 0.0094
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0049 0.1117 0.0866
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0142 0.7076 0.6906
Trypanosoma cruzi phosphatidylinositol 3-related kinase, putative 0.0049 0.1117 0.0866
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.0104 0.4618 0.6526
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.0084 0.337 0.432
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.007 0.2466 0.1518
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0069 0.2351 0.2757
Giardia lamblia GTOR 0.0142 0.7076 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0142 0.7076 0.6709
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.0104 0.4618 0.6232
Toxoplasma gondii target of rapamycin (TOR), putative 0.0106 0.4779 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2952 0.4171
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.1117 0.1579
Trichomonas vaginalis PIKK family atypical protein kinase 0.0122 0.5765 0.8147
Trichomonas vaginalis PIKK family atypical protein kinase 0.0106 0.4779 0.6753
Loa Loa (eye worm) phosphatidylinositol 3 0.0142 0.7076 0.8086
Trichomonas vaginalis PIKK family atypical protein kinase 0.0113 0.5242 0.7408
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.0041 0.0552 0.078
Trichomonas vaginalis PIKK family atypical protein kinase 0.0142 0.7076 1
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.0049 0.1117 0.0866
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2944 0.4161
Loa Loa (eye worm) phosphatidylinositol 3 0.0168 0.8752 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0086 0.3468 0.4901
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0142 0.7076 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0078 0.2952 0.4171
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0104 0.4618 0.6232
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.0092 0.3859 0.5068
Trichomonas vaginalis PIKK family atypical protein kinase 0.0085 0.3415 0.4826
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0049 0.1117 0.0866
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.0104 0.4618 0.6526

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.423 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.421 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.411 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.374 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.314 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.287 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.249 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.224 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.096 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference

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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