Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.60 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | PEPD | P12955 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2170717 | 1.00 | KIF11 (0.60) | KIF11GLAPEPDALDH1A1NPC1 | |
| SCHEMBL2172524 | 1.00 | KIF11 (0.60) | KIF11GLAPEPDALDH1A1NPC1 | |
| SCHEMBL2170844 | 0.87 | ALDH1A1 (0.47) | KIF11GLAALDH1A1HPGDMEN1 | |
| SCHEMBL2171946 | 0.87 | ALDH1A1 (0.47) | KIF11GLAALDH1A1HPGDMEN1 | |
| SCHEMBL262073 | 0.87 | ALDH1A1 (0.47) | KIF11GLAALDH1A1HPGDMEN1 | |
| SCHEMBL1447652 | 0.84 | SMN1; SMN2 (0.56) | ALDH1A1HPGDMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2818448 | 0.82 | KIF11 (0.64) | KIF11GLAPEPDALDH1A1NPC1 | |
| SCHEMBL2172516 | 0.82 | KIF11 (0.64) | KIF11GLAPEPDALDH1A1NPC1 | |
| SCHEMBL11272564 | 0.80 | HPGD (0.49) | ALDH1A1HPGDMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5533028 | 0.80 | KIF11 (0.89) | KIF11GLAPEPDALDH1A1NPC1 |
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 |