Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 2/20 | 0.34 |
| ▸ | ACE | P12821 | 2/20 | 0.34 |
| ▸ | CPA1 | P15085 | 2/20 | 0.34 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16565978 | 0.85 | GAA (0.36) | CYP2C9ALDH1A1MMEACECPA1 | |
| SCHEMBL20197913 | 0.83 | CYP2C9 (0.43) | CYP2C9MEN1KMT2APSMB5CTSK | |
| SCHEMBL1657595 | 0.82 | ALDH1A1 (0.36) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL29160549 | 0.82 | ALDH1A1 (0.40) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL30686731 | 0.78 | CTSK (0.36) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL12066889 | 0.78 | CTSK (0.36) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL12066863 | 0.78 | CTSK (0.36) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL20827996 | 0.78 | PSMB5 (0.35) | MMEACECPA1ACE2PSMB5 | |
| SCHEMBL9637211 | 0.77 | PAX8 (0.46) | ALDH1A1MMEACECPA1ACE2 | |
| SCHEMBL16566040 | 0.74 | DPP4 (0.44) | ALDH1A1MMEACECPA1ACE2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6008228-A | COMPRISING A MIXTURE OF CARRIER MONOGLYCERIDES OF MEDIUM CHAIN-FATTY ACIDS | HOFFMAN-LA ROCHE INC. (US) | 1999-12-28 | — | — | US | disclosed |
| EP-0594540-B1 | Antiretroviral acyl compounds | CIBA GEIGY AG (CH) | 1998-04-01 | — | — | EP | disclosed |
| EP-0594540-A1 | Antiretroviral acyl compounds | CIBA-GEIGY AG (CH) | 1994-04-27 | — | — | EP | disclosed |