Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9583848 | 0.81 | HTR2C (0.33) | HTR2C | |
| SCHEMBL7300637 | 0.79 | HTR1A (0.33) | HTR2B | |
| SCHEMBL7293357 | 0.79 | ALDH1A1 (0.33) | HTR2CALDH1A1 | |
| SCHEMBL7292477 | 0.76 | TSHR (0.32) | ALDH1A1 | |
| SCHEMBL7290461 | 0.76 | KMT2A (0.37) | — | |
| SCHEMBL7298705 | 0.72 | HTR2C (0.32) | HTR2CHTR2BAHR | |
| SCHEMBL10737745 | 0.69 | PKM (0.50) | PKMNPSR1ALDH1A1 | |
| SCHEMBL7294563 | 0.67 | AHR (0.36) | HTR2CAHR | |
| SCHEMBL7290795 | 0.67 | HTR2C (0.42) | PKMNPSR1HTR2CHTR2BAHR | |
| SCHEMBL7298271 | 0.66 | NOTUM (0.37) | AHRCYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5260444-A | Cardiovascular, hypotensive | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1993-11-09 | — | — | US | disclosed |
| US-5208245-A | Hypotensive agents | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1993-05-04 | — | — | US | disclosed |
| EP-0460418-A2 | Novel Dihydropyridine derivative | WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) | 1991-12-11 | — | — | EP | disclosed |