Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.50 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 3/20 | 0.49 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9477114 | 1.00 | CYP3A4 (0.50) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9476546 | 0.99 | CYP3A4 (0.48) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9476540 | 0.99 | CYP3A4 (0.48) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9476777 | 0.96 | CYP3A4 (0.49) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9476765 | 0.96 | CYP3A4 (0.49) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9475693 | 0.90 | LMNA (0.48) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9475703 | 0.90 | LMNA (0.48) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9477491 | 0.86 | RARB (0.51) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9477473 | 0.86 | RARB (0.51) | CYP3A4MEN1USP2ALDH1A1LMNA | |
| SCHEMBL9477586 | 0.85 | HSD17B10 (0.53) | CYP3A4MEN1USP2ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0377469-B1 | A LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-5183587-A | LIQUID CRYSTALLINE COMPOUND | CHISSO CORPORATION (JP) | 1993-02-02 | — | — | US | disclosed |
| EP-0377469-A1 | A liquid crystalline compound | CHISSO CORPORATION (JP) | 1990-07-11 | — | — | EP | disclosed |