Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL23566407 | 0.91 | HTT (0.63) | HTTNPC1RAB9AATMMEN1 | |
| SCHEMBL28018732 | 0.84 | GRM5 (0.52) | HTTNPC1RAB9AL3MBTL1ATM | |
| SCHEMBL6176906 | 0.83 | HTT (0.54) | HTTNPC1RAB9AATMMEN1 | |
| SCHEMBL16244495 | 0.80 | KDM4E (0.50) | NPC1RAB9AL3MBTL1MAPTGRM5 | |
| SCHEMBL6174461 | 0.79 | HTT (0.56) | HTTNPC1RAB9AL3MBTL1ATM | |
| SCHEMBL19426861 | 0.78 | KDM4E (0.55) | HTTNPC1RAB9AL3MBTL1MEN1 | |
| SCHEMBL7532358 | 0.78 | KMT2A (0.68) | HTTNPC1RAB9AL3MBTL1ATM | |
| SCHEMBL12844413 | 0.78 | GRM5 (0.46) | NPC1RAB9AL3MBTL1GRM5 | |
| SCHEMBL30648563 | 0.76 | RAB9A (0.88) | HTTNPC1RAB9AATMMEN1 | |
| SCHEMBL3364009 | 0.76 | MME (0.52) | HTTNPC1RAB9AL3MBTL1ATM |
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-2734529-A1 | BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2014-05-28 | — | — | EP | disclosed |
| WO-2013010380-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-01-24 | — | — | WO | disclosed |