Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5122876 | 0.85 | MTNR1A (0.57) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL8965051 | 0.83 | ABCB1 (0.62) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL6034576 | 0.83 | MAOB (0.55) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL20954700 | 0.83 | MTNR1A (0.58) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL5779644 | 0.81 | MAOB (0.57) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL27563776 | 0.81 | MAOB (0.57) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL28451865 | 0.81 | HDAC8 (0.55) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL3712815 | 0.80 | MAOB (0.55) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL27469507 | 0.80 | MAOB (0.55) | ABCB1MTNR1AMTNR1BHTR1ADRD2 | |
| SCHEMBL4231254 | 0.80 | MAOB (0.51) | ABCB1MTNR1AMTNR1BHTR1ADRD2 |
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-0410379-B1 | Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins | MERRELL DOW PHARMA (US) | 1996-01-31 | — | — | EP | disclosed |
| US-5068465-A | Hypotensive agents or enzyme inhibitors for treatment of hypertension | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0410379-A2 | Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-01-30 | — | — | EP | disclosed |
| US-4981868-A | ENZYME INHIBITORS, HYPOTENSIVES | MERRELL DOW PHARMACEUTICAL (US) | 1991-01-01 | — | — | US | disclosed |