Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.37 |
| ▸ | PTGIR | P43119 | 1/20 | 0.36 |
| ▸ | CCKBR | P32239 | 4/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8920349 | 0.89 | RAMP1 (0.42) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL8922451 | 0.87 | LMNA (0.38) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL9362231 | 0.84 | ALDH1A1 (0.34) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL9366881 | 0.84 | ALDH1A1 (0.34) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL8922740 | 0.81 | HSD11B1 (0.33) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL8922129 | 0.81 | ALDH1A1 (0.32) | ALDH1A1MAPTPKMALOX15RAB9A | |
| SCHEMBL8921722 | 0.79 | RAMP1 (0.41) | MAPTUTS2RCCKBRTP53MDM2 | |
| SCHEMBL8920743 | 0.78 | RAMP1 (0.41) | ALDH1A1RAB9AUTS2RPTGIRCCKBR | |
| SCHEMBL8920178 | 0.78 | CCKBR (0.46) | CCKBR | |
| SCHEMBL8921138 | 0.77 | PLA2G10 (0.45) | ALDH1A1MAPTPKMALOX15RAB9A |
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 |