Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7752607 | 0.94 | ESR2 (0.63) | ESR2CYP3A4ALDH1A1SLC18A3HTT | |
| SCHEMBL11187396 | 0.89 | ESR2 (0.68) | ESR2CYP3A4TDP1NPC1RAB9A | |
| SCHEMBL11187392 | 0.89 | ESR2 (0.68) | ESR2CYP3A4TDP1NPC1RAB9A | |
| SCHEMBL7747118 | 0.88 | ESR2 (0.57) | ESR2CYP3A4ALDH1A1SLC18A3HTT | |
| SCHEMBL7747115 | 0.88 | ESR2 (0.57) | ESR2CYP3A4ALDH1A1SLC18A3HTT | |
| SCHEMBL7747122 | 0.88 | ESR2 (0.57) | ESR2CYP3A4ALDH1A1SLC18A3HTT | |
| SCHEMBL16425691 | 0.87 | ESR2 (0.52) | ESR2TDP1ALDH1A1NPC1RAB9A | |
| SCHEMBL20929764 | 0.84 | ESR2 (0.57) | ESR2TDP1NPC1RAB9AFFAR1 | |
| SCHEMBL7751601 | 0.83 | ESR2 (0.52) | ESR2CYP3A4ALDH1A1SLC18A3SPHK1 | |
| SCHEMBL7751598 | 0.83 | ESR2 (0.52) | ESR2CYP3A4TDP1ALDH1A1SLC18A3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022122871-A1 | DEVICE FOR THE REGULATION OF LIGHT TRANSMISSION | MERCK PATENT GMBH (DE) | 2022-06-16 | — | — | WO | disclosed |
| WO-2021233797-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2021-11-25 | — | — | WO | disclosed |
| EP-3529334-B1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-10-07 | — | — | EP | disclosed |
| WO-2020152206-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-07-30 | — | — | WO | disclosed |
| WO-2018073160-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-04-26 | — | — | WO | disclosed |