Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.65 |
| ▸ | RAB9A | P51151 | 4/20 | 0.65 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.65 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.65 |
| ▸ | RELA | Q04206 | 3/20 | 0.65 |
| ▸ | PKM | P14618 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 5/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2445183 | 1.00 | LMNA (0.67) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL12402287 | 0.82 | GAA (0.62) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2165009 | 0.81 | LMNA (0.59) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2165006 | 0.81 | LMNA (0.59) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL16956820 | 0.81 | RORC (0.50) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4940997 | 0.81 | GAA (0.64) | ALDH1A1SMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL4941002 | 0.81 | GAA (0.64) | ALDH1A1SMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL28969963 | 0.81 | NPC1 (0.64) | ALDH1A1SMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL16774334 | 0.80 | LMNA (1.00) | LMNAALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2571081 | 0.79 | MEN1 (0.79) | ALDH1A1SMN1; SMN2RAB9APKMCYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2366704-B1 | Inhibitors of serine proteases | VERTEX PHARMA (US) | 2013-10-23 | — | — | EP | disclosed |
| EP-2631238-A1 | Spirocyclic inhibitors of serine proteases for the treatment of hcv infections | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-08-28 | — | — | EP | disclosed |
| EP-1917269-B1 | INHIBITORS OF SERINE PROTEASES | VERTEX PHARMA (US) | 2011-10-26 | — | — | EP | disclosed |
| EP-2366704-A1 | Inhibitors of serine proteases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-09-21 | — | — | EP | disclosed |
| EP-2364984-A1 | Inhibitors of serine proteases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-09-14 | — | — | EP | disclosed |