Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.44 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.43 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.42 |
| ▸ | USP1 | O94782 | 1/20 | 0.42 |
| ▸ | VNN1 | O95497 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20873884 | 0.81 | GRM5 (0.47) | CYP11B2HRH3MBTD1L3MBTL3L3MBTL1 | |
| SCHEMBL20300218 | 0.73 | GRM5 (0.56) | HRH3MBTD1L3MBTL3L3MBTL1GRM5 | |
| SCHEMBL10076236 | 0.73 | GRM5 (0.56) | MBTD1L3MBTL3L3MBTL1GRM5GRM3 | |
| SCHEMBL15215745 | 0.72 | ALDH1A1 (0.52) | KDM4EALDH1A1POLBRAB9A | |
| SCHEMBL12074789 | 0.71 | KMT2A (0.71) | MBTD1L3MBTL3L3MBTL1GRM5GRM3 | |
| SCHEMBL21212583 | 0.71 | PROKR1 (0.57) | GRM5GRM3VNN1ALDH1A1HSP90AA1 | |
| SCHEMBL5909258 | 0.71 | GRM5 (0.54) | L3MBTL3L3MBTL1GRM5GRM3VNN1 | |
| SCHEMBL8275304 | 0.70 | GRM5 (0.56) | MBTD1L3MBTL3L3MBTL1GRM5GRM3 | |
| SCHEMBL8337811 | 0.70 | HSP90AA1 (0.56) | MBTD1L3MBTL3L3MBTL1GRM5GRM3 | |
| SCHEMBL22119220 | 0.70 | KDM4E (0.59) | GRM5GRM3VNN1KDM4EPOLB |
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-1753731-A2 | PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS | Pharmacia Corporation (US) | 2007-02-21 | — | — | EP | disclosed |
| WO-2004087677-A2 | PYRIMIDIN-4-ONE DERIVATIVES AND THEIR USE AS P38 KINASE MODULATORS | PHARMACIA CORPORATION (US) | 2004-10-14 | — | — | WO | disclosed |