Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | STS | P08842 | 2/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | PTPN6 | P29350 | 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 | |
|---|---|---|---|---|
| SCHEMBL7359427 | 0.90 | GPR119 (0.60) | GPR119ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL8668191 | 0.85 | F10 (0.50) | CHEK2HRH3 | |
| SCHEMBL24721250 | 0.83 | ALDH1A1 (0.65) | GPR119ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL12533230 | 0.82 | GPR119 (0.67) | GPR119ALDH1A1HTTCHEK2STS | |
| SCHEMBL13423015 | 0.81 | GPR119 (0.60) | GPR119ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL24117809 | 0.81 | GPR119 (0.57) | GPR119ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL7360622 | 0.81 | GPR119 (0.60) | GPR119ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL240683 | 0.80 | GPR119 (0.61) | GPR119ALDH1A1CHEK2STSPDE4A | |
| SCHEMBL74203 | 0.80 | GPR119 (0.67) | GPR119ALDH1A1CHEK2PDE4APDE4B | |
| SCHEMBL2735422 | 0.80 | GPR119 (0.67) | GPR119ALDH1A1CHEK2HRH3 |
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-0805681-A4 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1998-05-06 | — | — | EP | disclosed |
| EP-0805681-A1 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1997-11-12 | — | — | EP | disclosed |
| WO-1996022775-A1 | TOCOLYTIC OXYTOCIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1996-08-01 | — | — | WO | disclosed |