Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 3/20 | 0.63 |
| ▸ | MAOB | P27338 | 3/20 | 0.56 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.52 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.51 |
| ▸ | HPD | P32754 | 1/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6812774 | 0.91 | NR4A2 (0.62) | NR4A2MAOBNR1H4MRGPRX4NPC1 | |
| SCHEMBL6817166 | 0.84 | MAOB (0.59) | MAOBSMPD1NR1H4AKR1C2AKR1C1 | |
| SCHEMBL6352870 | 0.84 | AKR1C2 (0.70) | NR4A2MAOBSMPD1NR1H4MRGPRX4 | |
| SCHEMBL27921579 | 0.79 | NR4A2 (0.75) | NR4A2MAOBSMPD1MRGPRX4HPD | |
| SCHEMBL6816409 | 0.76 | SMPD1 (0.52) | SMPD1NR1H4AKR1C2AKR1C1NPC1 | |
| SCHEMBL6812445 | 0.75 | MAOB (0.58) | MAOBNR1H4ALDH1A1RAB9AMAOA | |
| SCHEMBL4208795 | 0.74 | NR4A2 (0.62) | NR4A2MAOBNR1H4MRGPRX4AKR1C2 | |
| SCHEMBL15825643 | 0.74 | SMPD1 (0.61) | NR4A2MAOBSMPD1NR1H4MRGPRX4 | |
| SCHEMBL6352019 | 0.73 | AKR1C2 (0.78) | NR4A2SMPD1NR1H4MRGPRX4AKR1C2 | |
| SCHEMBL6306323 | 0.72 | NR4A2 (0.70) | NR4A2MAOBMAOAPPARA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004018414-A2 | ANTIBACTERIAL AGENTS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-03-04 | — | — | WO | claimed |