Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 1.00 |
| ▸ | MAOB | P27338 | 2/20 | 0.64 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | CCR3 | P51677 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6397596 | 0.83 | MAOA (0.71) | MAOASLC6A3SIGMAR1HTR1ADRD2 | |
| SCHEMBL4315787 | 0.82 | MAOA (0.71) | MAOAMAOBSIGMAR1 | |
| SCHEMBL1427550 | 0.82 | MAOA (0.71) | MAOAMAOBSIGMAR1 | |
| SCHEMBL2178931 | 0.81 | MAOA (0.68) | MAOASIGMAR1ACHE | |
| SCHEMBL96004 | 0.79 | SLC6A3 (0.70) | MAOASLC6A3SIGMAR1HTR1ADRD2 | |
| SCHEMBL14407778 | 0.78 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL13150782 | 0.78 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL7264546 | 0.78 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL6056974 | 0.78 | SLC6A3 (0.83) | SLC6A3SIGMAR1HTR1ADRD2ACHE | |
| SCHEMBL4682940 | 0.76 | SLC6A3 (0.67) | MAOASLC6A3SIGMAR1HTR1ADRD2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230349869-A1 | METHODS AND SYSTEMS FOR OPIOID DETECTION | NAT TECH & ENG SOLUTIONS SANDIA LLC (US) | 2023-11-02 | — | — | US | disclosed |
| US-11733217-B1 | Methods and systems for opioid detection | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) | 2023-08-22 | — | — | US | disclosed |
| EP-0873317-A1 | PYRIMIDIN DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1998-10-28 | — | — | EP | disclosed |
| WO-1997013759-A1 | PYRIMIDIN DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-04-17 | — | — | WO | disclosed |