Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.42 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL630767 | 0.90 | ITGB1 (0.46) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL630266 | 0.86 | ITGB1 (0.49) | ALDH1A1PKMMAPK1NPSR1ITGB1 | |
| SCHEMBL630786 | 0.83 | TDP1 (0.46) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL631343 | 0.83 | PKM (0.43) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL631194 | 0.82 | ITGB1 (0.47) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL631775 | 0.80 | LMNA (0.47) | ALDH1A1PKMCYP2C19LMNASMN1; SMN2 | |
| SCHEMBL631233 | 0.79 | FKBP1A (0.46) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL630470 | 0.79 | MEN1 (0.48) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL630023 | 0.77 | AKR1C3 (0.44) | ALDH1A1PKMFKBP1AMAPK1NPSR1 | |
| SCHEMBL631075 | 0.76 | FKBP1A (0.43) | PKMFKBP1AITGB1ITGA5POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1778637-B1 | FKBP-binding composition and pharmaceutical use thereof | AVENTIS PHARMA INC (US) | 2012-02-22 | — | — | EP | claimed |