Pyridine, 1-acetyl-1,2,3,4-tetrahydro-5-(1-(1H-indol-3-ylmethyl)-2-piperidinyl)-
| Internal ID | 6c254e87-35b5-4051-80f2-fdee9397ca87 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Indoles > 3-alkylindoles |
| IUPAC Name | 1-[5-[1-(1H-indol-3-ylmethyl)piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone |
| SMILES (Canonical) | CC(=O)N1CCCC(=C1)C2CCCCN2CC3=CNC4=CC=CC=C43 |
| SMILES (Isomeric) | CC(=O)N1CCCC(=C1)C2CCCCN2CC3=CNC4=CC=CC=C43 |
| InChI | InChI=1S/C21H27N3O/c1-16(25)23-12-6-7-17(14-23)21-10-4-5-11-24(21)15-18-13-22-20-9-3-2-8-19(18)20/h2-3,8-9,13-14,21-22H,4-7,10-12,15H2,1H3 |
| InChI Key | YRVWJJHMGFKSBV-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C21H27N3O |
| Molecular Weight | 337.50 g/mol |
| Exact Mass | 337.215412493 g/mol |
| Topological Polar Surface Area (TPSA) | 39.30 Ų |
| XlogP | 2.40 |
| 83905-67-3 |
| Pyridine, 1-acetyl-1,2,3,4-tetrahydro-5-(1-(1H-indol-3-ylmethyl)-2-piperidinyl)- |
| 1-[5-[1-(1H-indol-3-ylmethyl)piperidin-2-yl]-3,4-dihydro-2H-pyridin-1-yl]ethanone |
| SCHEMBL3133075 |
| DTXSID701004050 |
| AKOS040734262 |
| 1-[5-{1-[(1H-Indol-3-yl)methyl]piperidin-2-yl}-3,4-dihydropyridin-1(2H)-yl]ethan-1-one |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.85% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.39% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.25% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.93% | 95.56% |
| CHEMBL3155 | P34969 | Serotonin 7 (5-HT7) receptor | 93.99% | 90.71% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 88.23% | 92.62% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 86.28% | 94.45% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 85.89% | 99.23% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 85.45% | 89.00% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 84.76% | 93.03% |
| CHEMBL2535 | P11166 | Glucose transporter | 84.40% | 98.75% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.72% | 95.89% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 83.39% | 98.59% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 83.12% | 90.08% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 82.86% | 97.64% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 82.70% | 88.56% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 81.45% | 97.09% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 81.33% | 93.04% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 81.26% | 93.99% |
| CHEMBL2096618 | P11274 | Bcr/Abl fusion protein | 80.67% | 85.83% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| Lupinus arbustus |
| PubChem | 158591 |
| LOTUS | LTS0140520 |
| wikiData | Q82998841 |