Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL805163 | 0.83 | ALDH1A1 (0.46) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL13826533 | 0.83 | ALDH1A1 (0.49) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL13719298 | 0.79 | MAPT (0.45) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL12715362 | 0.79 | CYP3A4 (0.56) | ALDH1A1MAPTCYP2D6CYP2A6CYP2B6 | |
| SCHEMBL6875538 | 0.78 | SLC2A1 (0.43) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL27990412 | 0.77 | MAPT (0.49) | NPC1RAB9AALDH1A1MAPTPKM | |
| SCHEMBL9603258 | 0.76 | CYP2A6 (0.49) | ALDH1A1MAPTSMN1; SMN2CYP2D6CYP2A6 | |
| SCHEMBL11505498 | 0.74 | CYP3A4 (0.66) | NPC1ALDH1A1MAPTPKMSMN1; SMN2 | |
| SCHEMBL15996807 | 0.73 | MAPT (0.50) | NPC1RAB9AALDH1A1MAPTPKM | |
| Hydrochloric Acid SCHEMBL11504513 | 0.73 | CYP2A6 (0.63) | NPC1ALDH1A1MAPTPKMSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103012381-B | Benzofuran compound, preparation method thereof and application of benzofuran compound in preparation of antiarrhythmic drugs | UNIV SHANDONG | 2015-01-07 | — | — | CN | disclosed |