Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.35 |
| ▸ | PTGIR | P43119 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6015851 | 1.00 | HTT (0.38) | HTTATML3MBTL1SLC18A3PTGIR | |
| SCHEMBL9384486 | 0.88 | SLC18A3 (0.39) | HTTATML3MBTL1SLC18A3PTGIR | |
| SCHEMBL9386696 | 0.84 | MTNR1A (0.36) | MAPTMCHR1 | |
| SCHEMBL1999145 | 0.81 | BUB1 (0.32) | HTTATML3MBTL1S1PR1 | |
| SCHEMBL8449850 | 0.80 | DGAT1 (0.45) | PTGIRALDH1A1MAPTPOLB | |
| SCHEMBL1991216 | 0.79 | GBA1 (0.33) | HTTATML3MBTL1NPC1RAB9A | |
| SCHEMBL8324468 | 0.79 | GBA1 (0.33) | HTTATML3MBTL1NPC1RAB9A | |
| SCHEMBL9384846 | 0.79 | SLC18A3 (0.36) | HTTATML3MBTL1SLC18A3PTGIR | |
| SCHEMBL1998038 | 0.77 | FKBP1A (0.32) | — | |
| SCHEMBL9387801 | 0.77 | SLC6A2 (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0574783-B1 | Asymmetric hydrogenation | HOFFMANN LA ROCHE (CH) | 1999-10-06 | — | — | EP | disclosed |
| EP-0540956-B1 | Process for the manufacture of substituted maleimides | HOFFMANN LA ROCHE (CH) | 1997-09-03 | — | — | EP | disclosed |
| US-5399712-A | Protein kinase C inhibitor | HOFFMANN-LA ROCHE INC. (US) | 1995-03-21 | — | — | US | disclosed |
| EP-0540956-A1 | Process for the manufacture of substituted maleimides | F. HOFFMANN-LA ROCHE AG (CH) | 1993-05-12 | — | — | EP | disclosed |