Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.32 |
| ▸ | CCKBR | P32239 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9366881 | 0.86 | ALDH1A1 (0.34) | HSD11B1ALDH1A1MAPTALOX15PKM | |
| SCHEMBL8922129 | 0.84 | ALDH1A1 (0.32) | HSD11B1ALDH1A1MAPTALOX15PKM | |
| SCHEMBL8922121 | 0.81 | ALDH1A1 (0.39) | ALDH1A1MAPTALOX15PKMGAA | |
| SCHEMBL8922451 | 0.80 | LMNA (0.38) | ALDH1A1MAPTALOX15PKMGAA | |
| SCHEMBL9362231 | 0.78 | ALDH1A1 (0.34) | ALDH1A1MAPTALOX15PKMGAA | |
| SCHEMBL8920349 | 0.77 | RAMP1 (0.42) | ALDH1A1MAPTALOX15PKMGAA | |
| SCHEMBL9365841 | 0.74 | NPSR1 (0.32) | ALDH1A1MAPTALOX15PKM | |
| SCHEMBL8924472 | 0.72 | L3MBTL1 (0.33) | ALDH1A1MAPTALOX15PKM | |
| SCHEMBL8922568 | 0.71 | MAPT (0.32) | HSD11B1ALDH1A1MAPTALOX15PKM | |
| SCHEMBL9541317 | 0.71 | LMNA (0.38) | HSD11B1ALDH1A1MAPTALOX15PKM |
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 |
|---|---|---|---|---|---|---|---|
| US-5643904-A | Substituted hexahdryoazepinones and tetrahydrobenzazepinones | PFIZER INC. (US) | 1997-07-01 | — | — | US | disclosed |
| US-5484917-A | FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL DISORDERS, PAIN AND ANXIETY | PFIZER INC. (US) | 1996-01-16 | — | — | US | disclosed |
| WO-1993015059-A1 | 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS | PFIZER INC. (US) | 1993-08-05 | — | — | WO | disclosed |