Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | PPARA | Q07869 | 2/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6656147 | 0.89 | FAAH (0.41) | FAAHSMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL6654077 | 0.82 | PLA2G10 (0.46) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL3663293 | 0.80 | FAAH (0.58) | FAAHSMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL7447309 | 0.79 | CTSK (0.45) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL15564679 | 0.79 | ALDH1A1 (0.43) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL6692027 | 0.77 | EPHX1 (0.41) | SMN1; SMN2NPC1RAB9AHPGDL3MBTL1 | |
| SCHEMBL6654285 | 0.77 | ITGB3 (0.41) | FAAHSMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL6656140 | 0.75 | TAS1R3 (0.43) | FAAHSMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL2910068 | 0.73 | CYP2C19 (0.47) | FAAHSMN1; SMN2HPGDL3MBTL1CTSK | |
| SCHEMBL3663289 | 0.72 | ACE (0.51) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1432678-A1 | HIV PROTEASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-06-30 | — | — | EP | disclosed |
| WO-2003029206-A1 | PREPARATION OF HIV PROTEASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2003-04-10 | — | — | WO | disclosed |