Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.38 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | DRD3 | P35462 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.36 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 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 | |
|---|---|---|---|---|
| SCHEMBL875532 | 0.88 | S1PR1 (0.45) | ALDH1A1CARM1DRD2DRD4DRD3 | |
| SCHEMBL30093429 | 0.88 | S1PR1 (0.45) | ALDH1A1CARM1DRD2DRD4DRD3 | |
| SCHEMBL883754 | 0.83 | TSHR (0.44) | ALDH1A1CARM1DRD2DRD4DRD3 | |
| SCHEMBL883356 | 0.79 | KDM4E (0.45) | ALDH1A1DRD2DRD4DRD3KMT2A | |
| SCHEMBL15115353 | 0.78 | KDM4E (0.43) | ALDH1A1DRD2DRD4DRD3KMT2A | |
| SCHEMBL10695533 | 0.74 | RARB (0.53) | ALDH1A1KMT2AMEN1S1PR1S1PR3 | |
| SCHEMBL19542771 | 0.74 | RARB (0.47) | ALDH1A1KMT2AMEN1S1PR1S1PR3 | |
| SCHEMBL9563775 | 0.73 | CYP3A4 (0.49) | ALDH1A1KMT2AMEN1S1PR1S1PR3 | |
| SCHEMBL19824579 | 0.72 | DRD2 (0.49) | CARM1DRD2DRD4DRD3GAA | |
| SCHEMBL17897414 | 0.72 | CYP3A4 (0.61) | ALDH1A1KMT2ANPC1MEN1RARB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2619284-B2 | LIQUID CRYSTAL DISPLAYS AND LIQUID CRYSTALLINE MEDIA WITH HOMEOTROPIC ALIGNMENT | MERCK PATENT GMBH (DE) | 2022-12-28 | — | — | EP | disclosed |