Detailed information for compound 1474585

Basic information

Technical information
  • TDR Targets ID: 1474585
  • Name: 1-(4-chlorophenyl)-3-dimethylaminopropan-1-on e
  • MW: 211.688 | Formula: C11H14ClNO
  • H donors: 0 H acceptors: 1 LogP: 2.21 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(CCC(=O)c1ccc(cc1)Cl)C
  • InChi: 1S/C11H14ClNO/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3
  • InChiKey: WUYKWNHDYQFCMT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(4-chlorophenyl)-3-dimethylamino-propan-1-one
  • AIDS-018735
  • EU-0033935
  • p-Chloro-beta-dimethylaminopropiophenone
  • Maybridge1_004741
  • AIDS018735

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
Plasmodium vivax multidomain scavenger receptor, putative 0.0024 0.0049 0.1078
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0658 0.9887
Onchocerca volvulus Huntingtin homolog 0.0118 0.1212 0.3605
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0349 0.1225
Schistosoma mansoni vesicular acetylcholine transporter 0.0233 0.2616 0.2616
Schistosoma mansoni lipoxygenase 0.01 0.0981 0.0981
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0161 0.0567
Brugia malayi hypothetical protein 0.0118 0.1212 0.4257
Brugia malayi HSF-type DNA-binding domain containing protein 0.0096 0.0934 0.3282
Trypanosoma brucei trypanothione reductase 0.0057 0.0459 0.3958
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0057 0.0459 0.2985
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0065 0.0551 0.1793
Schistosoma mansoni hypothetical protein 0.0033 0.0161 0.0161
Trypanosoma brucei polo-like protein kinase 0.0114 0.1159 1
Schistosoma mansoni polycystin 1-related 0.0024 0.0049 0.0049
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0658 0.0658
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.02 0.02
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0349 0.1225
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0142 0.1507 0.1507
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0049 0.0049
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0658 0.9887
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.0451 0.1378
Schistosoma mansoni hypothetical protein 0.0024 0.0049 0.0049
Schistosoma mansoni loxhd1 0.0024 0.0049 0.0049
Loa Loa (eye worm) glutathione reductase 0.0057 0.0459 0.1463
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.002 0 0.5
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0184 0.0184
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0658 0.4283
Onchocerca volvulus 0.0036 0.02 0.0467
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0074 0.0666 0.5744
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0049 0.0049
Echinococcus multilocularis RUN 0.0024 0.0049 0.0049
Brugia malayi hypothetical protein 0.0024 0.0049 0.0174
Loa Loa (eye worm) hypothetical protein 0.0033 0.0161 0.0401
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.0451 0.1378
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.1159 1
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0233 0.2616 0.7963
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.02 0.02
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.1159 0.1159
Onchocerca volvulus Serine\/threonine kinase homolog 0.0114 0.1159 0.3442
Echinococcus granulosus RUN 0.0024 0.0049 0.0049
Plasmodium falciparum thioredoxin reductase 0.0057 0.0459 1
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0658 0.0658
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0783 0.9386 0.9386
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0658 0.9887
Plasmodium vivax SET domain protein, putative 0.0036 0.02 0.4358
Mycobacterium tuberculosis Probable reductase 0.013 0.1358 0.8837
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.1159 1
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0074 0.0666 0.0666
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0114 0.1159 0.1159
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.013 0.1358 0.8837
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Leishmania major trypanothione reductase 0.0057 0.0459 0.3958
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.02 0.02
Schistosoma mansoni lipoxygenase 0.0142 0.1507 0.1507
Loa Loa (eye worm) thioredoxin reductase 0.0057 0.0459 0.1463
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0658 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.02 0.02
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Plasmodium falciparum LCCL domain-containing protein 0.0024 0.0049 0.1078
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0349 0.107
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.002 0 0.5
Brugia malayi vesicular acetylcholine transporter unc-17 0.0233 0.2616 0.9193
Trypanosoma cruzi trypanothione reductase, putative 0.0057 0.0459 0.3958
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0145 0.1536 1
Brugia malayi Doublecortin family protein 0.0024 0.0049 0.0174
Onchocerca volvulus 0.0286 0.3273 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.02 0.0538
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0658 0.0658
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0658 0.5679
Echinococcus multilocularis vesicular acetylcholine transporter 0.0233 0.2616 0.2616
Plasmodium vivax glutathione reductase, putative 0.0057 0.0459 1
Onchocerca volvulus Huntingtin homolog 0.0118 0.1212 0.3605
Brugia malayi Pre-SET motif family protein 0.0036 0.02 0.0702
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0114 0.1159 0.1159
Brugia malayi Pre-SET motif family protein 0.0251 0.2846 1
Echinococcus granulosus thioredoxin glutathione reductase 0.0057 0.0459 0.0459
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0074 0.0666 1
Echinococcus granulosus vesicular acetylcholine transporter 0.0233 0.2616 0.2616
Schistosoma mansoni rab6-interacting 0.0024 0.0049 0.0049
Loa Loa (eye worm) hypothetical protein 0.0096 0.0934 0.3164
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0114 0.1159 1
Onchocerca volvulus Heat shock factor protein 2 homolog 0.0096 0.0934 0.2745
Echinococcus multilocularis lipoxygenase domain containing protein 0.0024 0.0049 0.0049
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.002 0 0.5
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0074 0.0666 0.0666
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0074 0.0666 0.0666
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0074 0.0666 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.02 0.02
Giardia lamblia Kinase, PLK 0.0114 0.1159 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.013 0.1358 0.8837
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.02 0.02
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.02 0.3037
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.2846 1
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Brugia malayi serine/threonine-protein kinase plk-2 0.0114 0.1159 0.4072
Loa Loa (eye worm) hypothetical protein 0.0048 0.0349 0.107
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0142 0.1507 0.1507
Mycobacterium tuberculosis Probable oxidoreductase 0.0145 0.1536 1
Mycobacterium tuberculosis Probable dehydrogenase 0.013 0.1358 0.8837
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0074 0.0666 0.2339
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.013 0.1358 0.8837
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0145 0.1536 1
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541
Brugia malayi Thioredoxin reductase 0.0057 0.0459 0.1612
Toxoplasma gondii thioredoxin reductase 0.0057 0.0459 0.697
Schistosoma mansoni kinase 0.0058 0.0469 0.0469
Plasmodium falciparum glutathione reductase 0.0057 0.0459 1
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0074 0.0666 0.4332
Entamoeba histolytica serine/threonine protein kinase, putative 0.0114 0.1159 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0145 0.1536 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.02 0.02
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0233 0.2616 0.9178
Echinococcus multilocularis Polycystic kidney disease protein 0.0024 0.0049 0.0049
Mycobacterium tuberculosis Putative ferredoxin reductase 0.013 0.1358 0.8837
Echinococcus granulosus Polycystic kidney disease protein 0.0024 0.0049 0.0049
Brugia malayi hypothetical protein 0.0024 0.0049 0.0174
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Brugia malayi glutathione reductase 0.0057 0.0459 0.1612
Trichomonas vaginalis set domain proteins, putative 0.0286 0.3273 1
Loa Loa (eye worm) hypothetical protein 0.0118 0.1212 0.4156
Echinococcus multilocularis thioredoxin glutathione reductase 0.0057 0.0459 0.0459
Loa Loa (eye worm) hypothetical protein 0.0118 0.1212 0.4156
Plasmodium vivax thioredoxin reductase, putative 0.0057 0.0459 1
Echinococcus granulosus lipoxygenase domain containing protein 0.0024 0.0049 0.0049
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0114 0.1159 0.3967
Treponema pallidum NADH oxidase 0.002 0 0.5
Schistosoma mansoni rab6-interacting 0.0024 0.0049 0.0049
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0658 0.0658
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.1159 0.3541

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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