Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL1711531 | 0.77 | ALDH1A1 (0.37) | BACE1KCNH2CYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL7783228 | 0.72 | ALDH1A1 (0.34) | BACE1KCNH2ALDH1A1MAPTHPGD | |
| SCHEMBL9846748 | 0.67 | TSHR (0.38) | CYP2C19CYP2C9ALDH1A1MAPTHPGD | |
| SCHEMBL1666766 | 0.66 | ALDH1A1 (0.35) | BACE1KCNH2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL30887002 | 0.64 | ALDH1A1 (0.34) | BACE1KCNH2ALDH1A1MAPTHPGD | |
| SCHEMBL29159516 | 0.64 | PGR (0.33) | — | |
| SCHEMBL27176761 | 0.64 | ALDH1A1 (0.34) | BACE1KCNH2ALDH1A1MAPTHPGD | |
| SCHEMBL5001689 | 0.64 | BACE1 (0.46) | BACE1KCNH2CYP2C19HSD17B10CYP2C9 | |
| SCHEMBL27403525 | 0.62 | KMT2A (0.36) | ALDH1A1 | |
| SCHEMBL31619199 | 0.61 | ALDH1A1 (0.33) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0450487-A1 | Benzoxazine derivatives, method for their preparation and their use for treating or prophylaxis of diseases | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-09 | — | — | EP | disclosed |