Detailed information for compound 213248

Basic information

Technical information
  • TDR Targets ID: 213248
  • Name: 4-cyclopropyl-1-methyl-3,6-dihydro-2H-pyridin e
  • MW: 137.222 | Formula: C9H15N
  • H donors: 0 H acceptors: 0 LogP: 1.42 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN1CCC(=CC1)C1CC1
  • InChi: 1S/C9H15N/c1-10-6-4-9(5-7-10)8-2-3-8/h4,8H,2-3,5-7H2,1H3
  • InChiKey: NLSPANXHFZMFDD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-cyclopropyl-1-methyl-1,2,3,6-tetrahydropyridine
  • 142798-26-3
  • 4-Cyclopropyl-1,2,3,6-tetrahydro-1-methylpyridine
  • Cme-thpyr
  • Pyridine, 4-cyclopropyl-1,2,3,6-tetrahydro-1-methyl-

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
Mycobacterium ulcerans multidrugs-transport integral membrane protein Mmr-like 0.0842 0.5496 0.7117
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0057 0.0187 0.0242
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0041 0.0076 0.0531
Trichomonas vaginalis D-aminoacylase, putative 0.0236 0.1395 0.1822
Schistosoma mansoni hypothetical protein 0.0558 0.3575 0.4254
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Schistosoma mansoni follistatin 0.0041 0.0076 0.0088
Mycobacterium ulcerans class a beta-lactamase, BlaC 0.0145 0.0779 0.0821
Schistosoma mansoni tar DNA-binding protein 0.0143 0.0763 0.0907
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0042 0.0081 0.0173
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0083 0.0109
Onchocerca volvulus 0.006 0.0205 0.1334
Trypanosoma cruzi hypothetical protein, conserved 0.0236 0.1395 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0046 0.0112 0.079
Loa Loa (eye worm) hypothetical protein 0.0086 0.0384 0.0499
Mycobacterium tuberculosis Conserved protein 0.0236 0.1395 0.1252
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0057 0.0187 0.0242
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0041 0.0076 0.0531
Mycobacterium ulcerans multidrug-transport integral membrane protein Mmr 0.0212 0.1234 0.1427
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Mycobacterium tuberculosis Conserved protein 0.0236 0.1395 0.1252
Echinococcus granulosus histone acetyltransferase KAT2B 0.0153 0.0835 0.2331
Echinococcus granulosus transcription factor btf3 0.0038 0.0053 0.0144
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0053 0.007
Echinococcus granulosus survival motor neuron protein 1 0.0275 0.1661 0.4644
Brugia malayi TAR-binding protein 0.0143 0.0763 0.0995
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0046 0.0112 0.079
Echinococcus granulosus snurportin 1 0.0321 0.197 0.5508
Mycobacterium ulcerans glutaminase 0.1162 0.7656 1
Echinococcus granulosus Solute carrier organic anion transporter family 0.006 0.0205 0.0568
Loa Loa (eye worm) hypothetical protein 0.0041 0.0076 0.0097
Loa Loa (eye worm) glutaminase 2 0.1162 0.7656 1
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0054 0.0164 0.0355
Brugia malayi intermediate filament protein 0.0086 0.0384 0.0499
Schistosoma mansoni chromobox protein 0.0075 0.0306 0.0362
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0041 0.0076 0.0097
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.0083 0.0447
Onchocerca volvulus 0.006 0.0205 0.1334
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0041 0.0076 0.0531
Echinococcus multilocularis beta LACTamase domain containing family member 0.0236 0.1395 0.3051
Loa Loa (eye worm) hypothetical protein 0.0085 0.0373 0.0485
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0236 0.1395 0.1252
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0041 0.0076 0.0097
Trichomonas vaginalis chromobox protein, putative 0.0045 0.0105 0.0137
Echinococcus granulosus organic anion transporting polypeptide 30B 0.006 0.0205 0.0568
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Trichomonas vaginalis chromobox protein, putative 0.0075 0.0306 0.04
Plasmodium falciparum histone acetyltransferase GCN5 0.0042 0.0086 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0057 0.0187 0.0996
Loa Loa (eye worm) glutaminase 0.1162 0.7656 1
Brugia malayi prostaglandin transporter 0.006 0.0205 0.0265
Brugia malayi hypothetical protein 0.0275 0.1661 0.2168
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0041 0.0076 0.0097
Mycobacterium leprae Probable lipase LipE 0.0236 0.1395 1
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.0083 0.0109
Echinococcus granulosus follistatin 0.0041 0.0076 0.0207
Echinococcus granulosus lamin 0.0086 0.0384 0.1068
Schistosoma mansoni hypothetical protein 0.0558 0.3575 0.4254
Toxoplasma gondii transporter, major facilitator family protein 0.006 0.0205 0.1456
Mycobacterium tuberculosis Conserved protein 0.0236 0.1395 0.1252
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0057 0.0187 0.0996
Brugia malayi RNA, U transporter 1 0.0086 0.0377 0.049
Schistosoma mansoni agrin 0.0041 0.0076 0.0088
Brugia malayi sodium-independent organic anion transporter family protein 0.006 0.0205 0.0265
Echinococcus multilocularis Solute carrier organic anion transporter family 0.006 0.0205 0.0444
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0042 0.0081 0.0221
Echinococcus multilocularis geminin 0.0558 0.3575 0.7823
Onchocerca volvulus 0.0236 0.1395 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0236 0.1395 0.1822
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0054 0.0164 0.0193
Echinococcus multilocularis snurportin 1 0.0321 0.197 0.4309
Schistosoma mansoni intracisternal A-particle retropepsin (A02 family) 0.1272 0.8401 1
Mycobacterium ulcerans lipoprotein LpqF 0.007 0.0269 0.014
Schistosoma mansoni lamin 0.0086 0.0384 0.0454
Echinococcus granulosus lamin dm0 0.0086 0.0384 0.1068
Schistosoma mansoni hypothetical protein 0.0321 0.197 0.2343
Mycobacterium ulcerans beta-lactamase 0.0236 0.1395 0.1643
Loa Loa (eye worm) sodium-independent organic anion transporter 0.006 0.0205 0.0265
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0043 0.0092 0.0117
Brugia malayi Intermediate filament tail domain containing protein 0.0086 0.0384 0.0499
Echinococcus granulosus intermediate filament protein 0.0086 0.0384 0.1068
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0054 0.0164 0.0454
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0046 0.0112 0.0144
Trichomonas vaginalis penicillin-binding protein, putative 0.0236 0.1395 0.1822
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Brugia malayi chromobox protein homolog 3 0.0042 0.0083 0.0106
Brugia malayi secreted modular calcium-binding protein 1 0.0041 0.0076 0.0097
Echinococcus multilocularis tar DNA binding protein 0.0143 0.0763 0.1667
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0054 0.0164 0.0212
Mycobacterium tuberculosis Probable hydrolase 0.0236 0.1395 0.1252
Trichomonas vaginalis esterase, putative 0.0236 0.1395 0.1822
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0236 0.1395 0.1659
Onchocerca volvulus 0.0056 0.0178 0.1142
Schistosoma mansoni lamin 0.0086 0.0384 0.0454
Brugia malayi hypothetical protein 0.006 0.0205 0.0265
Loa Loa (eye worm) hypothetical protein 0.0275 0.1661 0.2168
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0236 0.1395 0.1252
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Echinococcus multilocularis survival motor neuron protein 1 0.0275 0.1661 0.3633
Brugia malayi Heterochromatin protein 1 0.0075 0.0306 0.0397
Brugia malayi sodium-independent organic anion transporter family protein 0.006 0.0205 0.0265
Echinococcus multilocularis agrin 0.0041 0.0076 0.0162
Toxoplasma gondii protease inhibitor PI2 0.0041 0.0076 0.0531
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Brugia malayi RNA recognition motif domain containing protein 0.0143 0.0763 0.0995
Loa Loa (eye worm) TAR-binding protein 0.0143 0.0763 0.0995
Loa Loa (eye worm) heterochromatin protein 1 0.0075 0.0306 0.0397
Brugia malayi hypothetical protein 0.006 0.0205 0.0265
Echinococcus multilocularis transcription factor Dp 1 0.0033 0.0023 0.0047
Loa Loa (eye worm) hypothetical protein 0.0041 0.0076 0.0097
Schistosoma mansoni tar DNA-binding protein 0.0143 0.0763 0.0907
Mycobacterium tuberculosis Class a beta-lactamase BlaC 0.0145 0.0779 0.0625
Onchocerca volvulus 0.006 0.0205 0.1334
Mycobacterium ulcerans hypothetical protein 0.0236 0.1395 0.1643
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0057 0.0187 0.1327
Mycobacterium tuberculosis Probable lipase LipD 0.0236 0.1395 0.1252
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0054 0.0164 0.0826
Onchocerca volvulus 0.0236 0.1395 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0057 0.0187 0.0996
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0057 0.0187 0.0518
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0143 0.0763 0.0995
Schistosoma mansoni tar DNA-binding protein 0.0143 0.0763 0.0907
Schistosoma mansoni intermediate filament proteins 0.0086 0.0384 0.0454
Echinococcus granulosus chromobox protein 1 0.0075 0.0306 0.0851
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0057 0.0187 1
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Onchocerca volvulus 0.0086 0.0384 0.2635
Echinococcus multilocularis musashi 0.0086 0.0384 0.0836
Brugia malayi beta-NAC-like protein 0.0038 0.0053 0.0067
Trichomonas vaginalis D-aminoacylase, putative 0.0236 0.1395 0.1822
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0053 0.007
Mycobacterium leprae conserved hypothetical protein 0.0236 0.1395 1
Brugia malayi sodium-independent organic anion transporter family protein 0.006 0.0205 0.0265
Schistosoma mansoni glutaminase 0.1162 0.7656 0.9114
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Loa Loa (eye worm) kazal-type serine protease inhibitor domain-containing protein 0.0041 0.0076 0.0097
Trichomonas vaginalis chromobox protein, putative 0.0045 0.0105 0.0137
Onchocerca volvulus 0.006 0.0205 0.1334
Loa Loa (eye worm) beta-lactamase 0.0236 0.1395 0.182
Echinococcus granulosus tar DNA binding protein 0.0143 0.0763 0.2131
Echinococcus granulosus transcription factor Dp 1 0.0033 0.0023 0.006
Echinococcus granulosus histone acetyltransferase KAT2B 0.0046 0.0112 0.0308
Schistosoma mansoni tar DNA-binding protein 0.0143 0.0763 0.0907
Echinococcus multilocularis expressed protein 0.0041 0.0076 0.0162
Toxoplasma gondii ABC1 family protein 0.0236 0.1395 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0236 0.1395 0.182
Loa Loa (eye worm) hypothetical protein 0.004 0.007 0.0089
Onchocerca volvulus 0.006 0.0205 0.1334
Loa Loa (eye worm) intermediate filament protein 0.0086 0.0384 0.0499
Trichomonas vaginalis bromodomain-containing protein, putative 0.0046 0.0112 0.0146
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Brugia malayi Calcitonin receptor-like protein seb-1 0.0043 0.0092 0.0117
Schistosoma mansoni survival motor neuron protein 0.0056 0.0178 0.021
Onchocerca volvulus Putative organic anion transporter 0.006 0.0205 0.1334
Echinococcus granulosus geminin 0.0558 0.3575 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0056 0.0178 0.0231
Trypanosoma cruzi hypothetical protein, conserved 0.0236 0.1395 1
Toxoplasma gondii Kazal-type serine protease inhibitor domain-containing protein 0.0041 0.0076 0.0531
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Onchocerca volvulus 0.0236 0.1395 1
Loa Loa (eye worm) agrin synaptic family protein 0.0041 0.0076 0.0097
Loa Loa (eye worm) hypothetical protein 0.0041 0.0076 0.0097
Trichomonas vaginalis D-aminoacylase, putative 0.0236 0.1395 0.1822
Brugia malayi acetyltransferase, GNAT family protein 0.0158 0.0864 0.1127
Plasmodium falciparum basic transcription factor 3b, putative 0.0038 0.0053 0.6113
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0236 0.1395 0.182
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0086 0.0384 0.0499
Echinococcus multilocularis lamin 0.0086 0.0384 0.0836
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0043 0.0092 0.0117
Plasmodium vivax hypothetical protein, conserved 0.0236 0.1395 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0158 0.0864 0.1027
Mycobacterium ulcerans lipase LipD 0.0236 0.1395 0.1643
Brugia malayi beta-lactamase family protein 0.0236 0.1395 0.182
Loa Loa (eye worm) RNA binding protein 0.0143 0.0763 0.0995
Echinococcus multilocularis organic anion transporting polypeptide 30B 0.006 0.0205 0.0444
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0057 0.0187 0.0405
Echinococcus granulosus chromobox protein 1 0.0075 0.0306 0.0851
Trypanosoma cruzi MFS transporter, putative 0.006 0.0205 0.1129
Brugia malayi beta-lactamase 0.0236 0.1395 0.182
Toxoplasma gondii NAC domain-containing protein 0.0038 0.0053 0.0368
Echinococcus multilocularis chromobox protein 1 0.0075 0.0306 0.0666
Onchocerca volvulus Putative organic anion transporter 0.006 0.0205 0.1334
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0047 0.0113 0.0146
Plasmodium vivax basic transcription factor 3b, putative 0.0038 0.0053 0.0368
Loa Loa (eye worm) hypothetical protein 0.0236 0.1395 0.182
Mycobacterium tuberculosis Probable conserved lipoprotein LpqF 0.007 0.0269 0.0107
Trypanosoma brucei hypothetical protein, conserved 0.0236 0.1395 1
Loa Loa (eye worm) ICD-1 protein 0.0038 0.0053 0.0067
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0236 0.1395 0.1659
Schistosoma mansoni chromobox protein 0.0075 0.0306 0.0362
Loa Loa (eye worm) hypothetical protein 0.0043 0.0092 0.0117
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0236 0.1395 0.1643
Entamoeba histolytica acetyltransferase, GNAT family 0.0042 0.0086 0.2442
Trichomonas vaginalis chromobox protein, putative 0.0075 0.0306 0.04
Echinococcus granulosus agrin 0.0041 0.0076 0.0207
Mycobacterium tuberculosis Probable esterase LipL 0.0236 0.1395 0.1252
Echinococcus granulosus beta LACTamase domain containing family member 0.0236 0.1395 0.39
Brugia malayi glutaminase DH11.1 0.1162 0.7656 1
Trypanosoma brucei beta lactamase 0.007 0.0269 0.1918
Onchocerca volvulus 0.0086 0.0384 0.2635
Loa Loa (eye worm) hypothetical protein 0.0041 0.0076 0.0097
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0045 0.0105 0.0605
Brugia malayi cytoplasmic intermediate filament protein 0.0046 0.0112 0.0144
Echinococcus multilocularis lamin dm0 0.0086 0.0384 0.0836
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0321 0.197 0.2571
Giardia lamblia Histone acetyltransferase GCN5 0.0042 0.0086 0.5
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0046 0.0112 0.079
Schistosoma mansoni organic anion transporter 0.006 0.0205 0.0242
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0158 0.0864 0.1889
Brugia malayi Kazal-type serine protease inhibitor domain containing protein 0.0041 0.0076 0.0097
Leishmania major hypothetical protein, conserved 0.0236 0.1395 1
Echinococcus multilocularis transcription factor btf3 0.0038 0.0053 0.0112
Schistosoma mansoni organic anion transporter 0.006 0.0205 0.0242
Mycobacterium tuberculosis Probable lipase LipE 0.0236 0.1395 0.1252
Schistosoma mansoni family A2 unassigned peptidase (A02 family) 0.0231 0.1363 0.162
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0236 0.1395 0.1252
Mycobacterium ulcerans esterase/lipase LipP 0.0236 0.1395 0.1643
Loa Loa (eye worm) acetyltransferase 0.0158 0.0864 0.1127
Brugia malayi SPARC precursor 0.0041 0.0076 0.0097
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0046 0.0112 0.0146
Schistosoma mansoni transcription factor btf3 0.0038 0.0053 0.0061
Schistosoma mansoni hypothetical protein 0.0056 0.0178 0.021
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0705 0.4569 1
Onchocerca volvulus Putative organic anion transporter 0.006 0.0205 0.1334
Trichomonas vaginalis glutaminase, putative 0.1162 0.7656 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0081 0.0103
Trichomonas vaginalis conserved hypothetical protein 0.0038 0.0053 0.007
Loa Loa (eye worm) hypothetical protein 0.006 0.0205 0.0265
Loa Loa (eye worm) hypothetical protein 0.0033 0.0022 0.0026
Brugia malayi RNA binding protein 0.0143 0.0763 0.0995
Brugia malayi beta-lactamase family protein 0.0236 0.1395 0.182
Schistosoma mansoni hypothetical protein 0.0056 0.0179 0.0211
Trypanosoma brucei transcription factor BTF3, putative 0.0038 0.0053 0.0368
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0057 0.0187 0.022
Echinococcus multilocularis follistatin 0.0041 0.0076 0.0162
Loa Loa (eye worm) hypothetical protein 0.0042 0.0083 0.0106
Onchocerca volvulus 0.0041 0.0076 0.0395
Loa Loa (eye worm) hypothetical protein 0.004 0.007 0.0089
Schistosoma mansoni tar DNA-binding protein 0.0143 0.0763 0.0907
Echinococcus multilocularis chromobox protein 1 0.0075 0.0306 0.0666

Activities

Activity type Activity value Assay description Source Reference
Ratio (binding) = 974 Ratio of Kcat and KM against monoamine oxidase B (MAO-B) from beef liver was calculated ChEMBL. 8809158

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

1 literature reference was collected for this gene.

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