Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 5/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MLKL | Q8NB16 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28200881 | 0.88 | MAPT (0.45) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| Hydrochloric Acid SCHEMBL28200249 | 0.87 | MAPT (0.47) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL9663611 | 0.86 | ALDH1A1 (0.46) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6 | |
| Setazindol SCHEMBL160950 | 0.86 | SLC6A4 (0.48) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL9665191 | 0.83 | MEN1 (0.49) | SLC6A2SLC6A4SLC6A3CYP2D6ALDH1A1 | |
| SCHEMBL9463220 | 0.81 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL24497314 | 0.75 | SLC6A4 (0.40) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL9666074 | 0.75 | OPRM1 (0.49) | SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL3180280 | 0.74 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 | |
| SCHEMBL8805155 | 0.73 | GAA (0.56) | SLC6A2SLC6A4SLC6A3MAPTCYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5162371-A | Benzylamine Devivatives | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1992-11-10 | — | — | US | disclosed |
| US-5028630-A | Benzylamines | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1991-07-02 | — | — | US | disclosed |