Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.62 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.59 |
| ▸ | MAOB | P27338 | 3/20 | 0.57 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.56 |
| ▸ | HRH1 | P35367 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9201087 | 1.00 | MAOA (0.62) | MAOASCN9AMAOBHRH3HRH1 | |
| Hydrochloric Acid SCHEMBL5967428 | 0.98 | MAOA (0.61) | MAOASCN9AMAOBHRH3HRH1 | |
| SCHEMBL17666275 | 0.95 | MAOA (0.65) | MAOASCN9AMAOBHRH3HRH1 | |
| SCHEMBL23440921 | 0.92 | MAOB (0.67) | MAOASCN9AMAOBHRH3HRH1 | |
| SCHEMBL28424984 | 0.90 | MAOA (0.60) | MAOASCN9AMAOBHRH3HRH1 | |
| SCHEMBL2716941 | 0.89 | ALDH1A1 (0.51) | MAOA | |
| SCHEMBL6237220 | 0.85 | LDHA (0.57) | — | |
| SCHEMBL28049334 | 0.85 | LDHA (0.57) | — | |
| SCHEMBL14971737 | 0.85 | ALDH1A1 (0.51) | MAOA | |
| SCHEMBL8804625 | 0.84 | MAOA (0.53) | MAOASCN9AMAOB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0775140-A1 | SPIRO-SUBSTITUTED AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 1997-05-28 | — | — | EP | claimed |
| WO-1996005203-A1 | SPIRO-SUBSTITUTED AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 1996-02-22 | — | — | WO | claimed |
| EP-0680469-A1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | Dr. Karl Thomae GmbH (DE) | 1995-11-08 | — | — | EP | disclosed |
| WO-1994017035-A1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | DR. KARL THOMAE GMBH (DE) | 1994-08-04 | — | — | WO | disclosed |