Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11577946 | 0.99 | MAOB (0.37) | MAOBHRH3MTNR1BALDH1A1MTNR1A | |
| SCHEMBL11576248 | 0.85 | HRH3 (0.42) | HRH3MTNR1B | |
| SCHEMBL11575657 | 0.82 | ALDH1A1 (0.47) | MTNR1BALDH1A1MTNR1A | |
| SCHEMBL11575922 | 0.81 | HTR3A (0.41) | — | |
| SCHEMBL11576273 | 0.79 | NQO2 (0.40) | HRH3ALDH1A1 | |
| SCHEMBL11576126 | 0.78 | NQO2 (0.39) | HRH3ALDH1A1 | |
| SCHEMBL11577392 | 0.73 | POLB (0.43) | MAOBHRH3 | |
| SCHEMBL11599293 | 0.71 | POLB (0.49) | MTNR1BALDH1A1MTNR1A | |
| SCHEMBL11682864 | 0.70 | DRD2 (0.41) | ALDH1A1 | |
| SCHEMBL11794419 | 0.70 | DRD2 (0.52) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4032525-A | CNS DEPRESSANTS, NEUROLEPTICS | HOFFMANN-LA ROCHE INC. (US) | 1977-06-28 | — | — | US | claimed |
| US-4118572-A | CNS DEPRESSANTS, NEUROLEPTIC AGENTS, SCHIZOPHRENIA, TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1978-10-03 | — | — | US | disclosed |
| US-4105664-A | Dibenz[b,f]oxepin derivatives | HOFFMANN-LA ROCHE INC. (US) | 1978-08-08 | — | — | US | disclosed |
| US-4100173-A | DEPRESSANTS, SCHIZOPHRENIA, TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1978-07-11 | — | — | US | disclosed |
| US-4091023-A | ANTISCHIZOPHRENIA AGENTS, TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1978-05-23 | — | — | US | disclosed |