Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8769496 | 0.86 | TSHR (0.38) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL7750849 | 0.83 | TSHR (0.39) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL7754447 | 0.83 | TSHR (0.39) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL7754453 | 0.81 | TSHR (0.41) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL7750899 | 0.77 | CES1 (0.47) | TSHRMEN1THRBHTTKMT2A | |
| SCHEMBL7754047 | 0.75 | CES1 (0.49) | TSHRMEN1THRBHTTKMT2A | |
| SCHEMBL7560064 | 0.74 | TSHR (0.45) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL7563945 | 0.74 | CES1 (0.43) | TSHRCYP3A4MEN1THRBHTT | |
| SCHEMBL28974267 | 0.74 | CES1 (0.33) | CES1 | |
| SCHEMBL8642597 | 0.73 | TSHR (0.46) | TSHRCYP3A4MEN1THRBHTT |
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-0792255-B1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING & MFG (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1996015092-A1 | LIQUID CRYSTAL COMPOUNDS HAVING PERFLUOROETHER TERMINAL PORTIONS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-05-23 | — | — | WO | disclosed |
| US-5482650-A | Liquid crystal compounds having perfluoroether terminal portions | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-01-09 | — | — | US | disclosed |