Detailed information for compound 1424176

Basic information

Technical information
  • TDR Targets ID: 1424176
  • Name: N-(3-dimethylaminopropyl)-2-fluoro-N-[4-(4-me thoxyphenyl)-1,3-thiazol-2-yl]benzamide
  • MW: 413.508 | Formula: C22H24FN3O2S
  • H donors: 0 H acceptors: 2 LogP: 4.43 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)c1csc(n1)N(C(=O)c1ccccc1F)CCCN(C)C
  • InChi: 1S/C22H24FN3O2S/c1-25(2)13-6-14-26(21(27)18-7-4-5-8-19(18)23)22-24-20(15-29-22)16-9-11-17(28-3)12-10-16/h4-5,7-12,15H,6,13-14H2,1-3H3
  • InChiKey: WADIRGDZYGASFZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(3-dimethylaminopropyl)-2-fluoro-N-[4-(4-methoxyphenyl)thiazol-2-yl]benzamide
  • N-(3-dimethylaminopropyl)-2-fluoro-N-[4-(4-methoxyphenyl)-2-thiazolyl]benzamide
  • ASN 03270278

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 granulosus zinc finger protein 0.0024 0.0298 0.0472
Loa Loa (eye worm) hypothetical protein 0.0032 0.058 0.0927
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0032 0.0557 0.5508
Schistosoma mansoni zinc finger protein 0.0024 0.0298 0.0221
Loa Loa (eye worm) hypothetical protein 0.0078 0.2081 0.3347
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0946 0.1518
Mycobacterium tuberculosis Probable hydrolase 0.0043 0.0946 0.0484
Mycobacterium leprae Probable lipase LipE 0.0043 0.0946 0.5
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.058 0.1561
Brugia malayi hypothetical protein 0.0026 0.0362 0.0576
Brugia malayi RNA binding protein 0.0127 0.366 0.5892
Toxoplasma gondii isocitrate dehydrogenase 0.0032 0.0557 0.1397
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0065 0.1641 0.2638
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0167 0.0089
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.006 0.1488 0.2356
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0946 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0205 0.6209 1
Schistosoma mansoni sex comb on midleg homolog 0.0053 0.1249 0.118
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0272 0.0431
Echinococcus multilocularis lysine specific demethylase 5A 0.0039 0.0801 0.1268
Echinococcus multilocularis tar DNA binding protein 0.0127 0.366 0.5795
Loa Loa (eye worm) hypothetical protein 0.002 0.0167 0.0263
Schistosoma mansoni tar DNA-binding protein 0.0127 0.366 0.361
Echinococcus multilocularis PHD finger protein rhinoceros 0.0032 0.058 0.0918
Brugia malayi jmjC domain containing protein 0.0106 0.2975 0.4788
Loa Loa (eye worm) hypothetical protein 0.014 0.4095 0.6592
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0557 0.5508
Brugia malayi F/Y-rich N-terminus family protein 0.0023 0.0286 0.0453
Loa Loa (eye worm) hypothetical protein 0.0049 0.1131 0.1817
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Mycobacterium tuberculosis Probable esterase LipL 0.0043 0.0946 0.0484
Echinococcus multilocularis histone acetyltransferase MYST2 0.006 0.1488 0.2356
Echinococcus granulosus polycomb protein SCMH1 0.0053 0.1249 0.1978
Mycobacterium tuberculosis Conserved protein 0.0043 0.0946 0.0484
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0208 0.6316 1
Plasmodium vivax hypothetical protein, conserved 0.0032 0.058 0.3729
Brugia malayi mbt repeat family protein 0.0053 0.1249 0.2007
Giardia lamblia PHD finger protein 15 0.0032 0.058 0.5
Echinococcus granulosus PHD finger protein rhinoceros 0.0032 0.058 0.0918
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0032 0.0557 0.3337
Loa Loa (eye worm) latrophilin receptor protein 2 0.0065 0.1641 0.2638
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0362 0.3259
Loa Loa (eye worm) RNA binding protein 0.0127 0.366 0.5892
Brugia malayi Isocitrate dehydrogenase 0.0032 0.0557 0.089
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0032 0.0557 0.895
Brugia malayi isocitrate dehydrogenase 0.0032 0.0557 0.089
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0032 0.0557 0.0881
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0935 0.148
Onchocerca volvulus 0.0053 0.1249 1
Onchocerca volvulus 0.0043 0.0946 0.5472
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0946 0.1498
Loa Loa (eye worm) MBCTL1 0.006 0.1488 0.2391
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0043 0.0946 0.0484
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0946 0.0874
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0659 0.1055
Mycobacterium tuberculosis Probable lipase LipE 0.0043 0.0946 0.0484
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0106 0.2975 0.4711
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0946 1
Echinococcus granulosus methyl CpG binding domain protein 2 0.0019 0.0143 0.0226
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0205 0.6209 1
Schistosoma mansoni tar DNA-binding protein 0.0127 0.366 0.361
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0068 0.1747 0.2767
Schistosoma mansoni hypothetical protein 0.0065 0.1641 0.1574
Brugia malayi latrophilin 2 splice variant baaae 0.014 0.4095 0.6592
Brugia malayi beta-lactamase 0.0043 0.0946 0.1518
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.002 0.0167 0.0089
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0557 0.5508
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.1928 0.1864
Trichomonas vaginalis esterase, putative 0.0043 0.0946 0.5
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0824 0.1305
Echinococcus granulosus cpg binding protein 0.0039 0.0792 0.1255
Loa Loa (eye worm) hypothetical protein 0.0042 0.0912 0.1464
Loa Loa (eye worm) hypothetical protein 0.0055 0.1332 0.214
Loa Loa (eye worm) mbt repeat family protein 0.0053 0.1249 0.2007
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0053 0.1249 0.118
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0935 0.0862
Loa Loa (eye worm) isocitrate dehydrogenase 0.0032 0.0557 0.089
Brugia malayi beta-lactamase family protein 0.0043 0.0946 0.1518
Schistosoma mansoni cpg binding protein 0.0035 0.0659 0.0584
Echinococcus granulosus histone lysine methyltransferase setb 0.002 0.0167 0.0265
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0946 1
Schistosoma mansoni bromodomain containing protein 0.0072 0.1877 0.1812
Plasmodium falciparum phd finger protein, putative 0.0032 0.058 1
Brugia malayi mbt repeat family protein 0.0053 0.1249 0.2007
Mycobacterium ulcerans hypothetical protein 0.0043 0.0946 0.5
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0106 0.2975 0.4711
Leishmania major hypothetical protein, conserved 0.0026 0.0362 0.3259
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Brugia malayi PHD-finger family protein 0.003 0.0491 0.0784
Brugia malayi jmjC domain containing protein 0.0043 0.0935 0.15
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0143 0.0064
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.8596 1
Mycobacterium tuberculosis Conserved protein 0.0043 0.0946 0.0484
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0068 0.1747 0.2767
Schistosoma mansoni tar DNA-binding protein 0.0127 0.366 0.361
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0946 1
Brugia malayi Bromodomain containing protein 0.0042 0.091 0.146
Onchocerca volvulus 0.0043 0.0946 0.5472
Loa Loa (eye worm) hypothetical protein 0.0065 0.1641 0.2638
Loa Loa (eye worm) hypothetical protein 0.0026 0.0362 0.0576
Leishmania major hypothetical protein, conserved 0.0043 0.0946 1
Schistosoma mansoni cpg binding protein 0.0039 0.0792 0.0719
Schistosoma mansoni jumonji domain containing protein 0.0084 0.2267 0.2205
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0043 0.0946 0.0484
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0557 0.0881
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.0405 0.0329
Schistosoma mansoni hypothetical protein 0.0065 0.1641 0.1574
Brugia malayi beta-lactamase family protein 0.0043 0.0946 0.1518
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0946 0.0874
Echinococcus granulosus tar DNA binding protein 0.0127 0.366 0.5795
Schistosoma mansoni hypothetical protein 0.0023 0.0272 0.0194
Toxoplasma gondii PHD-finger domain-containing protein 0.0032 0.058 0.1561
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0127 0.366 0.5892
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0946 0.5
Mycobacterium tuberculosis Probable lipase LipD 0.0043 0.0946 0.0484
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0362 0.3259
Schistosoma mansoni methyl-cpg binding protein mbd 0.0019 0.0143 0.0064
Echinococcus multilocularis peregrin 0.0035 0.0665 0.1053
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0065 0.1641 0.2598
Schistosoma mansoni sex comb on midleg homolog 0.0053 0.1249 0.118
Brugia malayi CXXC zinc finger family protein 0.0035 0.0659 0.1055
Schistosoma mansoni cpg binding protein 0.0039 0.0792 0.0719
Loa Loa (eye worm) beta-lactamase 0.0043 0.0946 0.1518
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.0405 0.0642
Loa Loa (eye worm) TAR-binding protein 0.0127 0.366 0.5892
Brugia malayi hypothetical protein 0.0017 0.0066 0.0099
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.006 0.1488 0.2391
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0208 0.6316 1
Loa Loa (eye worm) PHD-finger family protein 0.0032 0.058 0.0927
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0019 0.0143 0.0226
Echinococcus granulosus GPCR family 2 0.0065 0.1641 0.2598
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0946 0.1498
Toxoplasma gondii isocitrate dehydrogenase 0.0032 0.0557 0.1397
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.006 0.1488 0.2356
Brugia malayi RNA recognition motif domain containing protein 0.0127 0.366 0.5892
Loa Loa (eye worm) hypothetical protein 0.0205 0.6209 1
Echinococcus granulosus SAM and MBT domain containing protein 0.0053 0.1249 0.1978
Loa Loa (eye worm) jmjC domain-containing protein 0.0067 0.1701 0.2734
Loa Loa (eye worm) hypothetical protein 0.006 0.1488 0.2391
Loa Loa (eye worm) hypothetical protein 0.0053 0.1249 0.2007
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.4234 0.6816
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0362 0.3259
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Schistosoma mansoni tar DNA-binding protein 0.0127 0.366 0.361
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0946 0.5
Toxoplasma gondii ABC1 family protein 0.0043 0.0946 0.4188
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0032 0.0557 0.5508
Schistosoma mansoni hypothetical protein 0.014 0.4095 0.4048
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.002 0.0167 0.0265
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0824 0.1305
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0557 0.0881
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0065 0.1641 0.2598
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0065 0.1641 0.2598
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0946 0.1518
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0032 0.058 0.0504
Brugia malayi TAR-binding protein 0.0127 0.366 0.5892
Schistosoma mansoni tar DNA-binding protein 0.0127 0.366 0.361
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.0405 0.0642
Onchocerca volvulus 0.0035 0.0659 0.1184
Echinococcus multilocularis zinc finger protein 0.0024 0.0298 0.0472
Mycobacterium leprae conserved hypothetical protein 0.0043 0.0946 0.5
Echinococcus multilocularis isocitrate dehydrogenase 0.0032 0.0557 0.0881
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0032 0.0557 0.0881
Brugia malayi Bromodomain containing protein 0.0085 0.23 0.37
Mycobacterium tuberculosis Conserved protein 0.0043 0.0946 0.0484
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.4234 0.6816
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0065 0.1641 0.2598
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0019 0.0152 0.0073
Onchocerca volvulus 0.0043 0.0946 0.5472
Brugia malayi MH2 domain containing protein 0.0144 0.4234 0.6816
Brugia malayi Calcitonin receptor-like protein seb-1 0.0205 0.6209 1
Echinococcus multilocularis GPCR, family 2 0.0065 0.1641 0.2598
Brugia malayi Latrophilin receptor protein 2 0.0065 0.1641 0.2638
Echinococcus multilocularis polycomb protein SCMH1 0.0053 0.1249 0.1978
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0946 0.5
Loa Loa (eye worm) hypothetical protein 0.0045 0.0998 0.1601
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0946 0.5
Schistosoma mansoni hypothetical protein 0.0065 0.1641 0.1574
Echinococcus multilocularis SAM and MBT domain containing protein 0.0053 0.1249 0.1978
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0946 0.5
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0946 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0032 0.0557 0.0881
Echinococcus granulosus histone acetyltransferase MYST2 0.006 0.1488 0.2356
Brugia malayi PHD-finger family protein 0.0032 0.058 0.0927
Loa Loa (eye worm) bromodomain containing protein 0.002 0.0165 0.0258
Schistosoma mansoni myelin transcription factor 1 myt1 0.006 0.1488 0.142
Echinococcus multilocularis jumonji domain containing protein 0.0045 0.0992 0.1571
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0043 0.0946 0.0484
Brugia malayi Bromodomain containing protein 0.0035 0.0665 0.1065
Schistosoma mansoni hypothetical protein 0.0065 0.1641 0.1574
Toxoplasma gondii histone lysine methyltransferase SET1 0.0068 0.1757 1
Mycobacterium ulcerans lipase LipD 0.0043 0.0946 0.5
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0032 0.0557 0.5508
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0946 1
Mycobacterium ulcerans beta-lactamase 0.0043 0.0946 0.5
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0032 0.0557 0.0481
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0053 0.1249 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0946 0.1518
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0935 0.0862
Schistosoma mansoni hypothetical protein 0.0032 0.058 0.0504
Echinococcus granulosus jumonji domain containing protein 0.0045 0.0992 0.1571
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0935 0.15
Echinococcus multilocularis cpg binding protein 0.0039 0.0792 0.1255
Echinococcus granulosus peregrin 0.0035 0.0665 0.1053

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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