Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Amitriptyline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 8/20 | 0.81 |
| ▸ | SLC6A4 known ✓ | P31645 | 6/20 | 0.81 |
| ▸ | HRH1 | P35367 | 8/20 | 0.81 |
| ▸ | LMNA | P02545 | 7/20 | 0.81 |
| ▸ | HTR2B | P41595 | 7/20 | 0.81 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.81 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.81 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.81 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.81 |
| ▸ | DRD2 | P14416 | 6/20 | 0.81 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.81 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.81 |
| ▸ | HTR2A | P28223 | 6/20 | 0.81 |
| ▸ | HTR2C | P28335 | 6/20 | 0.81 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.81 |
| ▸ | DRD3 | P35462 | 6/20 | 0.81 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.81 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.81 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.81 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.81 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Nortriptyline SCHEMBL34527 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Nortriptyline SCHEMBL1286980 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Amitriptyline SCHEMBL29359365 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Amitriptyline SCHEMBL2877708 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Amitriptyline SCHEMBL7824 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Nortriptyline SCHEMBL29362430 | 0.90 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Dothiepin SCHEMBL4076290 | 0.89 | SLC6A2 (0.78) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Amitriptyline SCHEMBL14937172 | 0.88 | SLC6A2 (1.00) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Nortriptyline SCHEMBL7158809 | 0.88 | SLC6A2 (0.97) | SLC6A2HRH1LMNAHTR2BKCNH2 | |
| Amitriptyline SCHEMBL7215255 | 0.88 | SLC6A2 (0.97) | SLC6A2HRH1LMNAHTR2BKCNH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240181077-A1 | AN ARTIFICIAL PROTEIN-CAGE COMPRISING ENCAPSULATED THEREIN A GUEST CARGO | UNIWERSYTET JAGIELLONSKI (PL) | 2024-06-06 | — | — | US | disclosed |
| US-20240139339-A1 | AN ARTIFICIAL PROTEIN-CAGE DECORATED WITH PARTICULAR MOLECULES ON THE EXTERIOR | UNIWERSYTET JAGIELLONSKI (PL) | 2024-05-02 | — | — | US | disclosed |
| EP-4298115-A1 | AN ARTIFICIAL PROTEIN-CAGE DECORATED WITH PARTICULAR MOLECULES ON THE EXTERIOR | UNIWERSYTET JAGIELLONSKI (PL) | 2024-01-03 | — | — | EP | disclosed |
| EP-4298117-A1 | AN ARTIFICIAL PROTEIN-CAGE COMPRISING ENCAPSULATED THEREIN A GUEST CARGO | UNIWERSYTET JAGIELLONSKI (PL) | 2024-01-03 | — | — | EP | disclosed |
| CN-103717597-B | Heterocyclic compounds as kinase inhibitors | 原真股份有限公司 | 2017-07-04 | — | — | CN | disclosed |
| EP-1703907-A4 | COMPOSITIONS AND METHODS TO TREAT RECURRENT MEDICAL CONDITIONS | MCDEVITT JASON (US) | 2009-03-25 | — | — | EP | disclosed |
| EP-1703907-A2 | COMPOSITIONS AND METHODS TO TREAT RECURRENT MEDICAL CONDITIONS | McDevitt, Jason (US) | 2006-09-27 | — | — | EP | disclosed |
| WO-2005065308-A2 | COMPOSITIONS AND METHODS TO TREAT RECURRENT MEDICAL CONDITIONS | MCDEVITT JASON (US) | 2005-07-21 | — | — | WO | disclosed |
| US-4310524-A | TCA Composition and method for rapid onset antidepressant therapy | RICHARDSON-MERRELL, INC. (US) | 1982-01-12 | — | — | US | disclosed |