Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | RARB | P10826 | 7/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8956744 | 1.00 | ALDH1A1 (0.50) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL9361459 | 0.91 | RARB (0.62) | ALDH1A1RARBTSHRMAPTKDM4E | |
| SCHEMBL10701492 | 0.91 | RARB (0.62) | ALDH1A1RARBTSHRMAPTKDM4E | |
| SCHEMBL14525682 | 0.91 | RARB (0.56) | ALDH1A1RARBTSHRMAPTKDM4E | |
| SCHEMBL7131644 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL9493320 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL7129914 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL7127663 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL7129328 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 | |
| SCHEMBL14273580 | 0.89 | ALDH1A1 (0.59) | ALDH1A1RARBTSHRMAPTPDCD1 |
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-5486310-A | Liquid crystalline mixtures having a chiral tilted smectic phase | HOFFMANN-LA ROCHE INC. (US) | 1996-01-23 | — | — | US | disclosed |
| EP-0339414-B1 | Optically active diester | HOFFMANN LA ROCHE (CH) | 1993-12-01 | — | — | EP | disclosed |
| US-5242619-A | Liquid crystalline mixtures having a chiral tilted smectic phase | HOFFMANN-LA ROCHE INC. (US) | 1993-09-07 | — | — | US | disclosed |
| EP-0339414-A2 | Optically active diester | F. HOFFMANN-LA ROCHE AG (CH) | 1989-11-02 | — | — | EP | disclosed |