Detailed information for compound 557233

Basic information

Technical information
  • TDR Targets ID: 557233
  • Name: 3-(7-chloro-5-oxo-benzo[b][1,8]naphthyridin-1 0-yl)propyl-dimethyl-ammonium chloride
  • MW: 352.258 | Formula: C17H19Cl2N3O
  • H donors: 1 H acceptors: 2 LogP: 4.2 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc2c(c1)c(=O)c1c(n2CCC[NH+](C)C)nccc1.[Cl-]
  • InChi: 1S/C17H18ClN3O.ClH/c1-20(2)9-4-10-21-15-7-6-12(18)11-14(15)16(22)13-5-3-8-19-17(13)21;/h3,5-8,11H,4,9-10H2,1-2H3;1H
  • InChiKey: DGUPZAJJVUHQHW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(7-chloro-5-oxo-10-benzo[b][1,8]naphthyridinyl)propyl-dimethylammonium chloride
  • 3-(7-chloro-5-oxo-benzo[b][1,8]naphthyridin-10-yl)propyl-dimethyl-azanium chloride
  • 3-(7-chloro-5-keto-benzo[b][1,8]naphthyridin-10-yl)propyl-dimethyl-ammonium chloride
  • 3-(7-chloro-5-oxobenzo[b][1,8]naphthyridin-10-yl)propyl-dimethylazanium chloride
  • 7-chloro-10-(3-dimethylaminopropyl)pyrido[2,3-b]quinolin-5-one hydrochloride
  • 7-chloro-10-(3-dimethylaminopropyl)-5-pyrido[2,3-b]quinolinone hydrochloride
  • 3-(7-chloro-5-oxopyrido[2,3-b]quinolin-10-yl)propyl-dimethylazanium chloride
  • 3-(7-chloro-5-oxo-pyrido[2,3-b]quinolin-10-yl)propyl-dimethyl-ammonium chloride
  • 3-(7-chloro-5-oxo-10-pyrido[2,3-b]quinolinyl)propyl-dimethylammonium chloride
  • 3-(7-chloro-5-keto-pyrido[2,3-b]quinolin-10-yl)propyl-dimethyl-ammonium chloride
  • 3-(7-chloro-5-oxo-pyrido[2,3-b]quinolin-10-yl)propyl-dimethyl-azanium chloride
  • 28907-44-0
  • 28907-45-1
  • 7-Chloro-10-(3-dimethylaminopropyl)-benzo-(b)(1,8)-5(10H)-naphthayridone hydrochloride
  • BENZO(b)(1,8)NAPHTHYRIDIN-5(10H)-ONE, 7-CHLORO-10-(3-(DIMETHYLAMINO)PROPYL)-, MO
  • Benzo(b)(1,8)naphthyridin-5(10H)-one, 7-chloro-10-(3-(dimethylamino)propyl)-, monohydrochloride
  • C 45
  • C 45 (pharmaceutical)
  • Chlorowodorku 10-gamma-dwumetyloaminopropylo-7-chlorobenzo(b)-(1,8)-naftyrydonu-5 [Polish]
  • IFC-45
  • IPF C-45

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) Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.0307
Echinococcus granulosus thioredoxin glutathione reductase 0.0055 0.0991 0.091
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0126 0.2759 0.3401
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.0175 0.0373
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Loa Loa (eye worm) glutathione reductase 0.0055 0.0991 0.0837
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0175 0.0373
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0019 0.009 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0724 0.064
Schistosoma mansoni sodium/chloride dependent transporter 0.0034 0.047 0.0384
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Loa Loa (eye worm) RNA binding protein 0.0074 0.146 0.1314
Toxoplasma gondii thioredoxin reductase 0.0055 0.0991 1
Toxoplasma gondii hypothetical protein 0.0034 0.047 0.4219
Schistosoma mansoni sodium-dependent amino acid transporter 0.0034 0.047 0.0384
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0034 0.047 0.0384
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0126 0.2759 0.3401
Plasmodium vivax nicotinate-nucleotide adenylyltransferase, putative 0.0332 0.7939 1
Brugia malayi hypothetical protein 0.0034 0.047 0.0831
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.4219
Plasmodium falciparum transporter, putative 0.0034 0.047 0.0485
Echinococcus granulosus dna polymerase eta 0.0022 0.0175 0.0086
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0175 0.0086
Loa Loa (eye worm) TAR-binding protein 0.0074 0.146 0.1314
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.047 0.0384
Onchocerca volvulus 0.0104 0.2217 0.4159
Schistosoma mansoni tar DNA-binding protein 0.0074 0.146 0.1383
Echinococcus granulosus tar DNA binding protein 0.0074 0.146 0.1383
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0074 0.146 0.1314
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.011 0.2368 1
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0175 0.0108
Schistosoma mansoni sodium/chloride dependent transporter 0.0202 0.467 0.4621
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Giardia lamblia Kinase, PLK 0.011 0.2368 1
Echinococcus multilocularis serotonin transporter 0.0202 0.467 0.4621
Brugia malayi TAR-binding protein 0.0074 0.146 0.2992
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Loa Loa (eye worm) hypothetical protein 0.0414 1 1
Brugia malayi Trypsin family protein 0.0104 0.2217 0.4644
Treponema pallidum sodium- and chloride- dependent transporter 0.0202 0.467 0.5835
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0034 0.047 0.0384
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Loa Loa (eye worm) hypothetical protein 0.0202 0.467 0.4578
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Schistosoma mansoni tar DNA-binding protein 0.0074 0.146 0.1383
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0976 0.389
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0175 0.0086
Loa Loa (eye worm) norepinephrine transporter 0.0202 0.467 0.4578
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0055 0.0991 0.1149
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.0831
Mycobacterium tuberculosis Probable oxidoreductase 0.014 0.3111 0.3848
Plasmodium falciparum nicotinamide/nicotinic acid mononucleotide adenylyltransferase 0.0332 0.7939 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.047 0.0384
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Loa Loa (eye worm) hypothetical protein 0.0202 0.467 0.4578
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0175 0.0373
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.014 0.3111 0.0678
Brugia malayi serine/threonine-protein kinase plk-2 0.011 0.2368 0.4975
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0175 0.0108
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0175 0.0738
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0019 0.009 0.0379
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0724 0.064
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0175 0.0373
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0034 0.047 0.0384
Trypanosoma brucei unspecified product 0.0022 0.0175 0.0738
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.047 0.0384
Schistosoma mansoni biogenic amine (5HT) receptor 0.0414 1 1
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0175 0.0108
Schistosoma mansoni tar DNA-binding protein 0.0074 0.146 0.1383
Mycobacterium ulcerans bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein 0.0332 0.7939 1
Loa Loa (eye worm) hypothetical protein 0.0414 1 1
Chlamydia trachomatis Ssodium-dependent amino acid transporter 0.0034 0.047 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0175 0.0373
Treponema pallidum hypothetical protein 0.0332 0.7939 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.0831
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0034 0.047 0.0831
Echinococcus granulosus serotonin transporter 0.0202 0.467 0.4621
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Plasmodium vivax thioredoxin reductase, putative 0.0055 0.0991 0.1149
Onchocerca volvulus Serine\/threonine kinase homolog 0.011 0.2368 0.452
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.2368 1
Echinococcus multilocularis serotonin receptor 0.0414 1 1
Schistosoma mansoni sodium/chloride dependent transporter 0.0035 0.0479 0.0393
Schistosoma mansoni tar DNA-binding protein 0.0074 0.146 0.1383
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0175 0.0186
Mycobacterium tuberculosis Probable reductase 0.0126 0.2759 0.3401
Loa Loa (eye worm) hypothetical protein 0.0022 0.0175 0.0006
Plasmodium falciparum glutathione reductase 0.0055 0.0991 0.1149
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0175 0.0738
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0104 0.2217 0.2146
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Echinococcus multilocularis serotonin receptor 0.0414 1 1
Onchocerca volvulus 0.0202 0.467 1
Plasmodium vivax glutathione reductase, putative 0.0055 0.0991 0.1149
Trypanosoma brucei polo-like protein kinase 0.011 0.2368 1
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0175 0.0186
Plasmodium falciparum amino acid transporter, putative 0.0034 0.047 0.0485
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.047 0.0384
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0175 0.0086
Schistosoma mansoni kinase 0.0056 0.1013 0.0931
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0104 0.2217 0.2146
Giardia lamblia DINP protein human, muc B family 0.0022 0.0175 0.0373
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0175 0.0086
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0175 0.0373
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0126 0.2759 0.3401
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0724 0.064
Plasmodium vivax hypothetical protein, conserved 0.0034 0.047 0.0485
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0724 0.0565
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0202 0.467 0.4621
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.014 0.3111 0.3848
Trypanosoma cruzi trypanothione reductase, putative 0.0055 0.0991 0.3958
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0724 0.064
Loa Loa (eye worm) solute carrier family 6 member 4 0.0202 0.467 0.4578
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.0175 0.0373
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0019 0.009 0.0379
Plasmodium falciparum thioredoxin reductase 0.0055 0.0991 0.1149
Onchocerca volvulus 0.0093 0.1945 0.3513
Leishmania major trypanothione reductase 0.0055 0.0991 0.3958
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Loa Loa (eye worm) serotonin transporter b 0.0202 0.467 0.4578
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.0831
Echinococcus granulosus dna polymerase kappa 0.0022 0.0175 0.0086
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0175 0.0006
Entamoeba histolytica serine/threonine protein kinase, putative 0.011 0.2368 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0724 0.064
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0175 0.0108
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0019 0.009 0.0379
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.4219
Leishmania major DNA polymerase eta, putative 0.0022 0.0175 0.0373
Mycobacterium leprae PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC 0.0332 0.7939 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.4219
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0034 0.047 0.0384
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0034 0.047 0.0384
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0034 0.047 0.0384
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Echinococcus multilocularis dna polymerase eta 0.0022 0.0175 0.0086
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Loa Loa (eye worm) thioredoxin reductase 0.0055 0.0991 0.0837
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.014 0.3111 0.3848
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0175 0.0373
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.011 0.2368 0.2237
Brugia malayi Thioredoxin reductase 0.0055 0.0991 0.1969
Schistosoma mansoni serine/threonine protein kinase 0.011 0.2368 0.2299
Echinococcus multilocularis tar DNA binding protein 0.0074 0.146 0.1383
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0019 0.009 0.0379
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0034 0.047 0.0384
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0724 0.064
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0175 0.0738
Leishmania major DNA polymerase kappa, putative 0.0022 0.0175 0.0373
Loa Loa (eye worm) hypothetical protein 0.0034 0.047 0.0307
Brugia malayi glutathione reductase 0.0055 0.0991 0.1969
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0724 0.064
Mycobacterium tuberculosis Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic 0.0332 0.7939 1
Loa Loa (eye worm) hypothetical protein 0.0202 0.467 0.4578
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0724 0.1386
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.011 0.2368 0.2299
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0175 0.0086
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0034 0.047 0.0384
Echinococcus granulosus sodium and chloride dependent glycine 0.0034 0.047 0.0384
Echinococcus multilocularis sodium and chloride dependent glycine 0.0034 0.047 0.0384
Mycobacterium tuberculosis Probable dehydrogenase 0.0126 0.2759 0.3401
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Trypanosoma brucei trypanothione reductase 0.0055 0.0991 0.4187
Brugia malayi RNA recognition motif domain containing protein 0.0074 0.146 0.2992
Loa Loa (eye worm) hypothetical protein 0.0104 0.2217 0.2083
Trypanosoma cruzi polo-like protein kinase, putative 0.011 0.2368 1
Plasmodium vivax amine transporter, putative 0.0034 0.047 0.0485
Loa Loa (eye worm) hypothetical protein 0.0104 0.2217 0.2083
Brugia malayi RNA binding protein 0.0074 0.146 0.2992
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0175 0.0738
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0034 0.047 0.0307
Echinococcus granulosus serine:threonine protein kinase PLK1 0.011 0.2368 0.2299
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0034 0.047 0.0384
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0202 0.467 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0126 0.2759 0.3401
Schistosoma mansoni DNA polymerase eta 0.0022 0.0175 0.0086
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0019 0.009 0.5
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0034 0.047 0.0384
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0976 0.389
Trichomonas vaginalis CAMK family protein kinase 0.011 0.2368 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0175 0.0738
Echinococcus granulosus sodium and chloride dependent glycine 0.0034 0.047 0.0384
Toxoplasma gondii hypothetical protein 0.0034 0.047 0.4219
Schistosoma mansoni tar DNA-binding protein 0.0074 0.146 0.1383
Echinococcus multilocularis thioredoxin glutathione reductase 0.0055 0.0991 0.091
Echinococcus multilocularis sodium and chloride dependent glycine 0.0034 0.047 0.0384
Brugia malayi Cytochrome P450 family protein 0.0022 0.0169 0.0172
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0034 0.047 0.0384

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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