Detailed information for compound 775419

Basic information

Technical information
  • TDR Targets ID: 775419
  • Name: 1-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-y l]-4-piperidin-1-ylpiperidine-4-carboxamide
  • MW: 402.462 | Formula: C21H27FN4O3
  • H donors: 1 H acceptors: 3 LogP: 1.15 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)N1C(=O)CC(C1=O)N1CCC(CC1)(C(=O)N)N1CCCCC1
  • InChi: 1S/C21H27FN4O3/c22-15-4-6-16(7-5-15)26-18(27)14-17(19(26)28)24-12-8-21(9-13-24,20(23)29)25-10-2-1-3-11-25/h4-7,17H,1-3,8-14H2,(H2,23,29)
  • InChiKey: UCQRUUKDYOFXLL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-[1-(4-fluorophenyl)-2,5-dioxo-pyrrolidin-3-yl]-4-(1-piperidyl)piperidine-4-carboxamide
  • 1-[1-(4-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]-4-(1-piperidyl)-4-piperidinecarboxamide
  • 1-[1-(4-fluorophenyl)-2,5-diketo-pyrrolidin-3-yl]-4-piperidino-isonipecotamide
  • 1-[1-(4-fluorophenyl)-2,5-dioxo-pyrrolidin-3-yl]-4-piperidin-1-yl-piperidine-4-carboxamide
  • EU-0015057
  • BAS 01915497
  • STK052509

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
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Schistosoma mansoni microtubule-associated protein tau 0.0675 0.4577 0.4577
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Loa Loa (eye worm) hypothetical protein 0.0149 0.0856 0.6922
Mycobacterium ulcerans beta-lactamase 0.0106 0.0547 1
Echinococcus granulosus microtubule associated protein 2 0.0675 0.4577 0.4577
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.0621 0.5026
Mycobacterium tuberculosis Probable hydrolase 0.0106 0.0547 0.1193
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0229 0.0229
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.0209 0.3821
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0061 0.0229 0.0499
Schistosoma mansoni glucose transport protein 0.0203 0.1236 0.1236
Trichomonas vaginalis D-aminoacylase, putative 0.0106 0.0547 0.0547
Toxoplasma gondii ABC1 family protein 0.0106 0.0547 0.4422
Brugia malayi beta-lactamase 0.0106 0.0547 0.4422
Toxoplasma gondii facilitative glucose transporter GT1 0.0203 0.1236 1
Brugia malayi latrophilin 2 splice variant baaae 0.0102 0.0521 0.4214
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0058 0.0209 0.0209
Trypanosoma brucei glucose transporter 1E 0.0063 0.0244 0.0244
Mycobacterium tuberculosis Conserved protein 0.0106 0.0547 0.1193
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0122 0.0122
Echinococcus multilocularis microtubule associated protein 2 0.0675 0.4577 0.4577
Trichomonas vaginalis conserved hypothetical protein 0.0063 0.0244 0.0244
Trypanosoma cruzi hypothetical protein, conserved 0.0106 0.0547 0.0547
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0106 0.0547 0.1193
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.0209 0.0209
Trypanosoma cruzi hexose transporter, putative 0.0063 0.0244 0.0244
Trypanosoma cruzi hexose transporter 0.0063 0.0244 0.0244
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0037 0.006 0.006
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0061 0.0229 0.0229
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0122 0.0122
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0058 0.0209 0.0209
Trypanosoma brucei DNA repair and recombination helicase protein PIF7 0.144 1 1
Trypanosoma cruzi hexose transporter, putative 0.0063 0.0244 0.0244
Trypanosoma cruzi hypothetical protein, conserved 0.0106 0.0547 0.0547
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0037 0.006 0.006
Trichomonas vaginalis penicillin-binding protein, putative 0.0106 0.0547 0.0547
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0106 0.0547 0.1193
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Plasmodium vivax hypothetical protein, conserved 0.0106 0.0547 0.4422
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0047 0.0132 0.0132
Leishmania major glucose transporter/membrane transporter D2, putative 0.0063 0.0244 0.0244
Trypanosoma cruzi hexose transporter, putative 0.0063 0.0244 0.0244
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0037 0.006 0.0486
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.0209 0.3821
Schistosoma mansoni hypothetical protein 0.0102 0.0521 0.0521
Mycobacterium tuberculosis Probable esterase LipL 0.0106 0.0547 0.1193
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Echinococcus granulosus GPCR family 2 0.0047 0.0132 0.0132
Loa Loa (eye worm) cytochrome P450 family protein 0.0044 0.0112 0.0903
Trypanosoma brucei glucose transporter 2A 0.0063 0.0244 0.0244
Brugia malayi Calcitonin receptor-like protein seb-1 0.0149 0.0856 0.6922
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0106 0.0547 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0149 0.0856 0.6922
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0037 0.006 0.006
Schistosoma mansoni hypothetical protein 0.0203 0.1236 0.1236
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0037 0.006 0.006
Trichomonas vaginalis sugar transporter, putative 0.0063 0.0244 0.0244
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0037 0.006 0.006
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.144 1 1
Mycobacterium leprae conserved hypothetical protein 0.0106 0.0547 0.5
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0037 0.006 0.006
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0061 0.0229 0.0229
Trichomonas vaginalis D-aminoacylase, putative 0.0106 0.0547 0.0547
Mycobacterium tuberculosis Probable lipase LipD 0.0106 0.0547 0.1193
Echinococcus granulosus tumor protein p63 0.0987 0.6788 0.6788
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0058 0.0209 0.169
Entamoeba histolytica hypothetical protein, conserved 0.144 1 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0229 0.4181
Plasmodium falciparum hexose transporter 0.0203 0.1236 1
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0037 0.006 0.006
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Toxoplasma gondii aldehyde dehydrogenase 0.0061 0.0229 0.1849
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0675 0.4582 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Echinococcus multilocularis GPCR, family 2 0.0047 0.0132 0.0132
Brugia malayi Sugar transporter family protein 0.0203 0.1236 1
Onchocerca volvulus 0.0106 0.0547 0.6659
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0037 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0037 0.006 0.0486
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0047 0.0132 0.0132
Echinococcus multilocularis beta LACTamase domain containing family member 0.0106 0.0547 0.0547
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0122 0.0122
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0106 0.0547 0.4422
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0037 0.006 0.006
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Trypanosoma brucei THT1 - hexose transporter, putative 0.0063 0.0244 0.0244
Trypanosoma brucei hypothetical protein, conserved 0.0106 0.0547 0.0547
Loa Loa (eye worm) sugar transporter 0.0203 0.1236 1
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0229 0.4181
Loa Loa (eye worm) hypothetical protein 0.0144 0.0821 0.6641
Schistosoma mansoni hypothetical protein 0.0047 0.0132 0.0132
Trypanosoma brucei THT1 - hexose transporter, putative 0.0063 0.0244 0.0244
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0122 0.0989
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0029 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0102 0.0521 0.4214
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0047 0.0132 0.0132
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.0229 0.0229
Entamoeba histolytica DNA repair and recombination protein, putative 0.144 1 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.0621 0.5026
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0203 0.1236 0.1236
Loa Loa (eye worm) latrophilin receptor protein 2 0.0047 0.0132 0.1072
Brugia malayi MH2 domain containing protein 0.0116 0.0621 0.5026
Mycobacterium ulcerans hypothetical protein 0.0106 0.0547 1
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0037 0.006 0.006
Mycobacterium tuberculosis Conserved protein 0.0106 0.0547 0.1193
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0106 0.0547 0.0547
Trypanosoma brucei THT1 - hexose transporter, putative 0.0063 0.0244 0.0244
Mycobacterium ulcerans lipase LipD 0.0106 0.0547 1
Mycobacterium ulcerans esterase/lipase LipP 0.0106 0.0547 1
Echinococcus multilocularis ATP dependent DNA helicase PIF1 0.144 1 1
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Leishmania major hypothetical protein, conserved 0.0106 0.0547 0.0547
Schistosoma mansoni cellular tumor antigen P53 0.0144 0.0821 0.0821
Schistosoma mansoni glucose transport protein 0.0203 0.1236 0.1236
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0042 0.0042
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0106 0.0547 0.0547
Trichomonas vaginalis conserved hypothetical protein 0.0203 0.1236 0.1236
Mycobacterium tuberculosis Probable lipase LipE 0.0106 0.0547 0.1193
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0047 0.0132 0.0132
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0061 0.0229 0.0229
Schistosoma mansoni hypothetical protein 0.0047 0.0132 0.0132
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Schistosoma mansoni hypothetical protein 0.0047 0.0132 0.0132
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0106 0.0547 0.1193
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0037 0.006 0.006
Trypanosoma cruzi DNA repair and recombination helicase protein PIF7, putative 0.144 1 1
Leishmania major glucose transporter, lmgt1 0.0063 0.0244 0.0244
Echinococcus granulosus beta LACTamase domain containing family member 0.0106 0.0547 0.0547
Echinococcus multilocularis ubiquitin specific protease 41 0.0037 0.006 0.006
Mycobacterium tuberculosis Conserved protein 0.0106 0.0547 0.1193
Leishmania major glucose transporter, lmgt2 0.0063 0.0244 0.0244
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0122 0.0122
Plasmodium vivax hexose transporter 0.0203 0.1236 1
Schistosoma mansoni hypothetical protein 0.0047 0.0132 0.0132
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Trichomonas vaginalis conserved hypothetical protein 0.144 1 1
Echinococcus multilocularis General substrate transporter 0.0174 0.1034 0.1034
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Onchocerca volvulus 0.0144 0.0821 1
Trichomonas vaginalis glucose transporter, putative 0.0063 0.0244 0.0244
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0122 0.0989
Schistosoma mansoni glucose transport protein 0.0203 0.1236 0.1236
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Onchocerca volvulus 0.0106 0.0547 0.6659
Schistosoma mansoni hypothetical protein 0.144 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0047 0.0132 0.1072
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0106 0.0547 0.4422
Brugia malayi Cytochrome P450 family protein 0.0044 0.0112 0.0903
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0122 0.0122
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.0209 0.0209
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.144 1 1
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0055 0.0189 0.0189
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0203 0.1236 0.1236
Leishmania major glucose transporter, lmgt3 0.0063 0.0244 0.0244
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.006 0.006
Trichomonas vaginalis glucose transporter, putative 0.0063 0.0244 0.0244
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0055 0.0189 0.0189
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0122 0.0122
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0122 0.0122
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0054 0.0181 0.1466
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0037 0.006 0.006
Trichomonas vaginalis penicillin-binding protein, putative 0.0106 0.0547 0.0547
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0149 0.0856 0.6922
Echinococcus granulosus General substrate transporter 0.0174 0.1034 0.1034
Echinococcus granulosus ubiquitin specific protease 41 0.0037 0.006 0.006
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.0229 0.4181
Trichomonas vaginalis D-aminoacylase, putative 0.0106 0.0547 0.0547
Trichomonas vaginalis esterase, putative 0.0106 0.0547 0.0547
Trypanosoma brucei DNA repair and recombination helicase protein PIF6 0.144 1 1
Brugia malayi beta-lactamase family protein 0.0106 0.0547 0.4422
Brugia malayi beta-lactamase family protein 0.0106 0.0547 0.4422
Loa Loa (eye worm) hypothetical protein 0.0047 0.0132 0.1072
Trypanosoma cruzi DNA repair and recombination helicase protein PIF6, putative 0.144 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0063 0.0244 0.0244
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0058 0.0209 0.0456
Onchocerca volvulus 0.0106 0.0547 0.6659
Giardia lamblia Rrm3p helicase 0.144 1 1
Leishmania major PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative 0.144 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.0547 0.4422
Brugia malayi Latrophilin receptor protein 2 0.0047 0.0132 0.1072
Trichomonas vaginalis sugar transporter, putative 0.0063 0.0244 0.0244
Mycobacterium leprae Probable lipase LipE 0.0106 0.0547 0.5
Schistosoma mansoni lipoxygenase 0.0055 0.0189 0.0189
Loa Loa (eye worm) beta-lactamase 0.0106 0.0547 0.4422
Echinococcus multilocularis tumor protein p63 0.0987 0.6788 0.6788
Trypanosoma brucei glucose transporter, putative 0.0063 0.0244 0.0244
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0037 0.006 0.006
Trichomonas vaginalis sugar transporter, putative 0.0063 0.0244 0.0244

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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