Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.64 |
| ▸ | PEPD | P12955 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.47 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL262075 | 0.86 | KIF11 (0.51) | KIF11MAPTGAAALDH1A1CYP26A1 | |
| SCHEMBL10683046 | 0.83 | SMN1; SMN2 (0.56) | MAPTGAAALDH1A1NPC1CYP26A1 | |
| SCHEMBL2191366 | 0.82 | KIF11 (0.89) | KIF11PEPDMAPTALDH1A1NPC1 | |
| SCHEMBL3497043 | 0.79 | MAPT (0.52) | MAPTALDH1A1CYP26A1CYP26B1HDAC3 | |
| SCHEMBL5425660 | 0.78 | KIF11 (1.00) | KIF11PEPDMAPTNPC1HDAC3 | |
| SCHEMBL5062623 | 0.77 | PEPD (0.80) | KIF11PEPDMAPTGAAGFER | |
| SCHEMBL23343691 | 0.76 | KIF11 (0.62) | KIF11PEPDMAPTGAAGFER | |
| SCHEMBL167549 | 0.75 | KIF11 (0.89) | KIF11PEPDMAPTALDH1A1NPC1 | |
| SCHEMBL2875784 | 0.75 | NPC1 (0.61) | KIF11PEPDMAPTGAAGFER | |
| SCHEMBL31510753 | 0.75 | KMT2A (0.50) | KIF11MAPTALDH1A1KMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8133911-B2 | (R)-4-(heteroaryl) phenylethyl derivatives and pharmaceutical compositions containing them | DOMPE S.P.A (IT) | 2012-03-13 | — | — | US | disclosed |
| EP-2201006-B1 | (R)-4-(HETEROARYL) PHENYLETHYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DOMPE SPA (IT) | 2011-03-09 | — | — | EP | disclosed |