Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4024928 | 0.78 | SLC6A3 (0.43) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL4064082 | 0.74 | ALDH1A1 (0.56) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL4021356 | 0.71 | SLC6A3 (0.40) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL4022171 | 0.71 | SLC6A3 (0.40) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL4021827 | 0.70 | SLC6A3 (0.42) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL17290387 | 0.70 | BRD4 (0.52) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL17295108 | 0.70 | BRD4 (0.52) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL4032283 | 0.69 | GAA (0.43) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL6444084 | 0.68 | MEN1 (0.49) | MEN1NPC1RAB9AKMT2ASLC6A3 | |
| SCHEMBL9644018 | 0.66 | SLC6A3 (0.62) | SLC6A3SLC6A4SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009100403-A1 | SUBSTITUTED ARYL PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |
| WO-2009100403-A1 | SUBSTITUTED ARYL PYRIMIDINONES | NEUROGEN CORPORATION (US) | 2009-08-13 | — | — | WO | disclosed |