Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.58 |
| ▸ | BCHE | P06276 | 2/20 | 0.58 |
| ▸ | MAOA | P21397 | 2/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.52 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.52 |
| ▸ | CDC25A | P30304 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.50 |
| ▸ | TGM2 | P21980 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5999219 | 0.85 | CES1 (0.79) | CES1BCHEMAOAMAOBALDH1A1 | |
| Isatin SCHEMBL5505028 | 0.83 | MAOA (0.57) | CES1BCHEMAOAMAOBALDH1A1 | |
| Isatin SCHEMBL25225927 | 0.80 | MAOA (0.74) | CES1BCHEMAOAMAOBALDH1A1 | |
| Isatin SCHEMBL9390159 | 0.77 | ALDH3A1 (0.65) | CES1BCHEALDH1A1ALDH3A1TP53 | |
| SCHEMBL25119569 | 0.76 | CES1 (0.85) | CES1BCHEMAOAMAOBALDH1A1 | |
| SCHEMBL19924204 | 0.75 | CES1 (1.00) | CES1BCHEMAOAMAOBALDH1A1 | |
| Isatin SCHEMBL5506077 | 0.75 | MAOA (0.50) | CES1BCHEMAOAMAOBALDH1A1 | |
| SCHEMBL25119255 | 0.74 | CES1 (0.84) | CES1BCHEMAOAMAOBALDH1A1 | |
| Isatin SCHEMBL34016 | 0.73 | MAOA (1.00) | CES1MAOAMAOBALDH1A1PKM | |
| Isatin SCHEMBL973760 | 0.73 | MAOA (1.00) | CES1MAOAMAOBALDH1A1PKM |
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-1781642-A1 | OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS | Pharmacia & Upjohn Company LLC (US) | 2007-05-09 | — | — | EP | disclosed |
| WO-2006016221-A1 | OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2006-02-16 | — | — | WO | disclosed |