Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 5/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14128769 | 0.90 | MAOA (0.53) | CA2CA5AHRH3ALDH1A1MAOB | |
| SCHEMBL5685785 | 0.88 | MAOB (0.49) | CA2CA5AHRH3ALDH1A1MAOB | |
| SCHEMBL1513396 | 0.81 | MAOB (0.46) | CA2PBRM1HRH3BRD4MAOB | |
| SCHEMBL251842 | 0.79 | MAOB (0.54) | PBRM1HRH3BRD4ALDH1A1MAOB | |
| SCHEMBL29392039 | 0.79 | MAOB (0.54) | PBRM1HRH3BRD4ALDH1A1MAOB | |
| SCHEMBL3821515 | 0.79 | MAOB (0.55) | MAOBMAOA | |
| SCHEMBL6130607 | 0.77 | MAPK14 (0.56) | MAOBKDM4E | |
| SCHEMBL30103244 | 0.75 | HRH3 (0.56) | PBRM1HRH3BRD4MAOBMAOA | |
| SCHEMBL29308778 | 0.75 | STS (0.62) | CA2CA5AALDH1A1HPGDSTS | |
| SCHEMBL6184702 | 0.75 | STS (0.68) | CA2CA5AHRH3ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0657426-B1 | Tricyclic pyrrole derivatives | HOFFMANN LA ROCHE (CH) | 1998-07-22 | — | — | EP | disclosed |
| US-5646173-A | ANTISEROTONINE AGENTS; CENTRAL NERVOUS SYSTEM DISORDERS; ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1997-07-08 | — | — | US | disclosed |
| EP-0657426-A2 | Tricyclic pyrrole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1995-06-14 | — | — | EP | disclosed |