Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4427203 | 0.77 | MAOA (0.61) | MAOAMAOBBCHECES1 | |
| SCHEMBL5642473 | 0.77 | MAOB (0.48) | MAOAMAOBEPHX2BCHECES1 | |
| SCHEMBL10844098 | 0.77 | AHR (0.49) | MAOAMAOBBCHECES1ACSL1 | |
| SCHEMBL2375779 | 0.77 | HPGD (0.52) | MAOAMAOBDRD3 | |
| SCHEMBL9740773 | 0.76 | MAOA (0.44) | MAOAMAOBBRD4PTGS2PTGS1 | |
| SCHEMBL14598854 | 0.76 | MAOA (0.44) | MAOAMAOBPTGS2PTGS1BCHE | |
| SCHEMBL19820969 | 0.76 | MAOA (0.44) | MAOAMAOBBCHECES1ACSL1 | |
| SCHEMBL10443908 | 0.74 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL5658535 | 0.73 | MAOA (0.52) | MAOAMAOBBCHECES1ACSL1 | |
| SCHEMBL9493015 | 0.72 | GAA (0.58) | MAOAMAOBBRD4PTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5140027-A | Antidepressants, analgesics and anticonvulsants | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1992-08-18 | — | — | US | disclosed |
| US-4943571-A | ANALGESICS, ANTICONVULSANTS, ANTIDEPRESSANTS | HOECHST-ROUSSEL PHAMRACEUTICALS INC. (US) | 1990-07-24 | — | — | US | disclosed |
| US-4837227-A | ANALGESICS, ANTIDEPRESSANTS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1989-06-06 | — | — | US | disclosed |
| EP-0002508-B1 | AMINOALKYLTHIODIBENZOXEPINES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | HOECHST AKTIENGESELLSCHAFT (DE) | 1982-03-31 | — | — | EP | disclosed |