Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.51 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7288434 | 1.00 | HRH3 (0.51) | HRH3MAOBMAPTGABRA1GABRB2 | |
| SCHEMBL4223600 | 0.92 | HRH3 (0.42) | HRH3MAOBMAPTALDH1A1CYP3A4 | |
| SCHEMBL9370374 | 0.86 | MAOB (0.39) | HRH3MAOBMAPTLMNAALDH1A1 | |
| SCHEMBL7288347 | 0.84 | HRH3 (0.49) | HRH3MAOBMAPTGABRA1GABRB2 | |
| SCHEMBL6631863 | 0.84 | MTNR1A (0.46) | MAPTLMNATP53ALDH1A1CYP3A4 | |
| SCHEMBL7288429 | 0.84 | HRH3 (0.49) | HRH3MAOBMAPTGABRA1GABRB2 | |
| SCHEMBL6895073 | 0.84 | MTNR1A (0.51) | MAPTLMNAALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL7670945 | 0.84 | MTNR1A (0.46) | MAPTLMNATP53ALDH1A1CYP3A4 | |
| SCHEMBL1041765 | 0.84 | MTNR1A (0.51) | MAPTLMNAALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL5968789 | 0.83 | CA2 (0.52) | HRH3MAOBMAPTLMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6359138-B1 | CENTRAL NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. | 2002-03-19 | — | — | US | disclosed |
| EP-0846683-B1 | 4-Hydroxy-piperidine derivatives | HOFFMANN LA ROCHE (CH) | 2001-09-19 | — | — | EP | disclosed |
| EP-0846683-A1 | 4-Hydroxy-piperidine derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1998-06-10 | — | — | EP | disclosed |