Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | RARB | P10826 | 3/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | RARA | P10276 | 1/20 | 0.36 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16852384 | 0.99 | NAAA (0.41) | NAAAMGLLTSHRMEN1TP53 | |
| SCHEMBL16852409 | 0.95 | NAAA (0.42) | NAAAMGLLTYRCTSLCTSS | |
| SCHEMBL16852367 | 0.93 | THRA (0.42) | MGLLTSHRMEN1TP53CYP3A4 | |
| SCHEMBL16852413 | 0.93 | THRA (0.40) | MGLLTSHRMEN1TP53CYP3A4 | |
| SCHEMBL16852376 | 0.93 | THRA (0.42) | MGLLTSHRMEN1TP53CYP3A4 | |
| SCHEMBL16852374 | 0.93 | THRA (0.42) | MGLLTSHRMEN1TP53CYP3A4 | |
| SCHEMBL16852386 | 0.91 | THRB (0.39) | MGLLTSHRMEN1TP53CYP3A4 | |
| SCHEMBL16852400 | 0.91 | S1PR1 (0.39) | MGLLTSHRMEN1MAPTHTT | |
| SCHEMBL16852430 | 0.91 | THRB (0.40) | MGLLMEN1MAPTHTTKMT2A | |
| SCHEMBL16852382 | 0.90 | THRA (0.42) | MGLLRARBCTSLCTSSCTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9951274-B2 | Liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2018-04-24 | — | — | US | disclosed |
| US-20150175884-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-25 | — | — | US | disclosed |