Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 9/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.56 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.53 |
| ▸ | HTR3B | O95264 | 1/20 | 0.53 |
| ▸ | HTR3A | P46098 | 1/20 | 0.53 |
| ▸ | HTR5A | P47898 | 1/20 | 0.53 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.53 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13664717 | 0.87 | SLC6A2 (0.63) | SLC6A4SLC6A2SLC6A3HTR3EHTR3B | |
| SCHEMBL27852746 | 0.85 | ALDH1A1 (0.54) | SLC6A4SLC6A2SLC6A3HTR6HSP90AA1 | |
| SCHEMBL28282299 | 0.80 | ALDH1A1 (0.53) | SLC6A4SLC6A2SLC6A3HTR6ALDH1A1 | |
| SCHEMBL13665288 | 0.78 | SLC6A2 (0.76) | SLC6A4SLC6A2SLC6A3SIGMAR1HTR6 | |
| SCHEMBL3782634 | 0.72 | SLC6A2 (0.54) | SLC6A4SLC6A2SLC6A3HTR3EHTR3B | |
| SCHEMBL13664706 | 0.71 | SLC6A2 (0.58) | SLC6A4SLC6A2SLC6A3HTR3EHTR3B | |
| SCHEMBL3138664 | 0.70 | HTR3A (1.00) | SLC6A4HTR3EHTR3BHTR3AHTR5A | |
| SCHEMBL30870394 | 0.70 | HTR3A (1.00) | SLC6A4HTR3EHTR3BHTR3AHTR5A | |
| SCHEMBL13664679 | 0.69 | SLC6A2 (1.00) | SLC6A4SLC6A2SLC6A3HTR3EHTR3B | |
| Hydrochloric Acid SCHEMBL29688470 | 0.68 | HTR3A (0.96) | SLC6A4HTR3EHTR3BHTR3AHTR5A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |