Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | LGMN | Q99538 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | OXTR | P30559 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11079923 | 0.83 | CES2 (0.47) | CES2CES1DPP9RECQLPKM | |
| SCHEMBL14735229 | 0.83 | LMNA (0.44) | — | |
| SCHEMBL5354523 | 0.81 | CES2 (0.50) | CES2CES1DPP9IDO1TDO2 | |
| SCHEMBL31294583 | 0.78 | POLB (0.43) | CES2CES1PKMALDH1A1IDO1 | |
| SCHEMBL19200282 | 0.77 | CES2 (0.49) | CES2CES1RECQLALDH1A1IDO1 | |
| SCHEMBL12332374 | 0.77 | TRPA1 (0.44) | CES2CES1RECQLPKMALDH1A1 | |
| SCHEMBL11548025 | 0.76 | LGMN (0.49) | LGMNALDH1A1CYP3A4 | |
| SCHEMBL12883179 | 0.75 | POLB (0.47) | ALDH1A1 | |
| SCHEMBL12686652 | 0.74 | MC4R (0.41) | CES2CES1RECQLPKMALDH1A1 | |
| SCHEMBL12686634 | 0.74 | MC4R (0.41) | CES2CES1RECQLPKMALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5478842-A | Antiinflammatory agents, antiallergens, drugs for treatment of diseases mediated by leukotrienes | ZENECA LIMITED (GB) | 1995-12-26 | — | — | US | disclosed |