Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ACP3 | P15309 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2673956 | 0.85 | SLC6A2 (0.45) | CA1CA2ALDH1A1HTTTSHR | |
| SCHEMBL11106772 | 0.80 | AOC3 (0.60) | AOC3CA1CA2ACHECNR2 | |
| SCHEMBL5122883 | 0.77 | CNR2 (0.54) | AOC3CA1CA2ACHECNR2 | |
| SCHEMBL28451883 | 0.77 | AOC3 (0.53) | AOC3CA1CA2ACHECNR2 | |
| SCHEMBL11754330 | 0.76 | ALDH1A1 (0.54) | CNR2LTA4HALDH1A1TSHRACP3 | |
| SCHEMBL11324514 | 0.75 | ATM (0.46) | AOC3LTA4HALDH1A1ACP3PBRM1 | |
| SCHEMBL10964256 | 0.75 | AOC3 (0.54) | AOC3CA1CA2ACHECNR2 | |
| SCHEMBL10964251 | 0.75 | CNR2 (0.51) | AOC3CA1CA2ACHECNR2 | |
| SCHEMBL3932308 | 0.73 | LTA4H (0.58) | AOC3LTA4HNPC1L3MBTL1FFAR1 | |
| SCHEMBL15514667 | 0.73 | LTA4H (0.53) | AOC3LTA4HALDH1A1HTTNPC1 |
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-4461726-A | Desulfurization of penicillins to prepare azetidinones | HOFFMANN-LA ROCHE INC. (US) | 1984-07-24 | — | — | US | disclosed |
| US-4195021-A | 1,3-Disubstituted 2-azetidinone antibitotics | ELI LILLY AND COMPANY (US) | 1980-03-25 | — | — | US | disclosed |
| EP-0001715-A2 | Azetidinone antibiotics and their pharmaceutical formulations and use | ELI LILLY AND COMPANY (US) | 1979-05-02 | — | — | EP | disclosed |