Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.63 |
| ▸ | RAB9A | P51151 | 4/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | GPR183 | P32249 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | TACR3 | P29371 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | CCR2 | P41597 | 1/20 | 0.53 |
| ▸ | ITGAL | P20701 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7302887 | 1.00 | NPC1 (0.63) | NPC1RAB9AGAAL3MBTL1MEN1 | |
| SCHEMBL27568108 | 0.87 | RAB9A (0.72) | NPC1RAB9AGAAL3MBTL1MEN1 | |
| SCHEMBL30716143 | 0.85 | GAA (0.67) | NPC1RAB9AGAAL3MBTL1MEN1 | |
| SCHEMBL27093043 | 0.85 | GAA (0.67) | NPC1RAB9AGAAL3MBTL1MEN1 | |
| SCHEMBL5324731 | 0.85 | NPC1 (0.66) | NPC1RAB9AMAPTSMN1; SMN2GPR183 | |
| SCHEMBL5324726 | 0.85 | NPC1 (0.66) | NPC1RAB9AMAPTSMN1; SMN2GPR183 | |
| SCHEMBL7303054 | 0.84 | LMNA (0.69) | NPC1RAB9AGAAMEN1KMT2A | |
| SCHEMBL7303060 | 0.84 | LMNA (0.69) | NPC1RAB9AGAAMEN1KMT2A | |
| SCHEMBL27490251 | 0.84 | NPC1 (0.77) | NPC1RAB9AGAAL3MBTL1MEN1 | |
| SCHEMBL7306010 | 0.84 | HTT (0.70) | NPC1RAB9AGAAL3MBTL1MEN1 |
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-0520336-A2 | Aldehyde derivatives and their use as calpain inhibitors | FUJIREBIO Inc. (JP) | 1992-12-30 | — | — | EP | disclosed |