Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 5/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL3005419 | 0.88 | AOC3 (0.51) | AOC3ATMKDM4ELMNAMAPK1 | |
| SCHEMBL517085 | 0.88 | AOC3 (0.40) | AOC3ATMKDM4ELMNAMAPK1 | |
| SCHEMBL17076303 | 0.88 | AOC3 (0.40) | AOC3ATMKDM4ELMNAMAPK1 | |
| SCHEMBL16932338 | 0.86 | LMNA (0.41) | AOC3RIPK1ATMKDM4ELMNA | |
| SCHEMBL15609906 | 0.83 | RIPK1 (0.39) | AOC3RIPK1ATMKDM4ELMNA | |
| SCHEMBL5065158 | 0.77 | KDM4E (0.55) | AOC3KDM4ELMNASLC6A4ALDH1A1 | |
| SCHEMBL14908702 | 0.77 | KDM4E (0.55) | AOC3KDM4ELMNASLC6A4ALDH1A1 | |
| SCHEMBL5065151 | 0.77 | KDM4E (0.55) | AOC3KDM4ELMNASLC6A4ALDH1A1 | |
| SCHEMBL28340791 | 0.76 | ATM (0.41) | AOC3ATMKDM4ELMNAMAPK1 | |
| SCHEMBL3326907 | 0.76 | AOC3 (0.44) | AOC3ATMKDM4ELMNAL3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0665215-A1 | 1,4-Diamino-2,3-dihydroxybutanes | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-08-02 | — | — | EP | disclosed |
| US-5430155-A | Viricides, treatment of AIDS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-07-04 | — | — | US | disclosed |
| US-5294720-A | Viricides | THE DUPONT MERCK PHARMACEUTICAL CO. (US) | 1994-03-15 | — | — | US | disclosed |