Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXFP1 | Q9HBX9 | 8/20 | 0.49 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.48 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | NCS1 | P62166 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17892576 | 0.89 | RXFP1 (0.62) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL15903435 | 0.87 | RXFP1 (0.63) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL18825314 | 0.86 | RAB9A (0.64) | RXFP1SORT1GAAMEN1NPC1 | |
| SCHEMBL15903061 | 0.85 | RXFP1 (0.51) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL15903292 | 0.84 | RXFP1 (0.52) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL15903266 | 0.82 | RXFP1 (0.49) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL15903089 | 0.80 | SORT1 (0.53) | RXFP1SORT1RIOK2GAANPC1 | |
| SCHEMBL30362400 | 0.78 | TRPV1 (0.57) | SORT1RIOK2GAAMEN1NPC1 | |
| SCHEMBL15903360 | 0.78 | SCN8A (0.49) | RXFP1SORT1RIOK2GAAMEN1 | |
| SCHEMBL17894006 | 0.78 | IDH2 (0.52) | RXFP1SORT1GAALMNAAR |
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-2948458-A1 | BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2015-12-02 | — | — | EP | claimed |
| WO-2014114185-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2014-07-31 | — | — | WO | claimed |
| EP-2948458-A1 | BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2015-12-02 | — | — | EP | disclosed |
| WO-2014114185-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2014-07-31 | — | — | WO | disclosed |