Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.48 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
| ▸ | HRH2 | P25021 | 4/20 | 0.45 |
| ▸ | HRH1 | P35367 | 4/20 | 0.45 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.45 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.45 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11524666 | 1.00 | HRH3 (0.48) | HRH3NQO1HRH2HRH1GRIA1 | |
| SCHEMBL9586183 | 0.88 | NQO1 (0.61) | HRH3NQO1MAOAMAOB | |
| SCHEMBL11524499 | 0.87 | RAB9A (0.52) | HRH3HRH2HRH1MAOAMAOB | |
| SCHEMBL11524495 | 0.87 | RAB9A (0.52) | HRH3HRH2HRH1MAOAMAOB | |
| SCHEMBL11524390 | 0.87 | HRH3 (0.49) | HRH3HRH2HRH1GRIA1GRIA2 | |
| SCHEMBL11524387 | 0.87 | HRH3 (0.49) | HRH3HRH2HRH1GRIA1GRIA2 | |
| SCHEMBL11615819 | 0.85 | NQO1 (0.45) | NQO1MAOAMAOBALDH1A1 | |
| SCHEMBL11527311 | 0.84 | KDM4E (0.52) | HRH3HRH2HRH1ALDH1A1 | |
| SCHEMBL11527316 | 0.84 | KDM4E (0.52) | HRH3HRH2HRH1ALDH1A1 | |
| SCHEMBL509602 | 0.84 | NQO1 (0.67) | HRH3NQO1MAOBALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4154697-A | Liquid crystalline hexahydroterphenyl derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1979-05-15 | — | — | US | disclosed |