Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4158770 | 0.80 | MEN1 (0.51) | GPR84TAAR1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL12144892 | 0.73 | DAO (0.39) | TAAR1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL13939838 | 0.72 | GPR84 (0.47) | GPR84SMN1; SMN2NPC1RAB9A | |
| SCHEMBL7876297 | 0.72 | TP53 (0.49) | SMN1; SMN2ALDH1A1MEN1KMT2ADAO | |
| SCHEMBL20119349 | 0.69 | HTT (0.47) | GPR84TAAR1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL7876283 | 0.69 | MAPT (0.47) | SMN1; SMN2NPC1RAB9APKM | |
| SCHEMBL3764101 | 0.69 | TAAR1 (0.41) | GPR84TAAR1SMN1; SMN2ADORA3ADORA2A | |
| SCHEMBL3913487 | 0.68 | TAAR1 (0.55) | GPR84TAAR1SMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL1846157 | 0.68 | MEN1 (0.45) | TAAR1SMN1; SMN2KDM4EADORA2AALDH1A1 | |
| SCHEMBL14622184 | 0.68 | KDM4E (0.46) | GPR84TAAR1SMN1; SMN2KDM4EADORA3 |
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-1086122-A1 | PYRAZINONE PROTEASE INHIBITORS | Johnson & Johnson Pharmaceutical Research & Development, L.L.C. (US) | 2001-03-28 | — | — | EP | disclosed |
| WO-1999064446-A1 | PYRAZINONE PROTEASE INHIBITORS | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 1999-12-16 | — | — | WO | disclosed |