Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL8387001 | 0.93 | CYP1A2 (0.35) | CYP1A2CYP2D6CYP2C9CYP2C19MAPK8 | |
| SCHEMBL3501336 | 0.78 | CYP1A2 (0.53) | CYP1A2CYP2D6CYP2C9CYP2C19MAPK8 | |
| SCHEMBL7655562 | 0.74 | GRIK1 (0.40) | — | |
| SCHEMBL7655559 | 0.74 | GRIK1 (0.40) | — | |
| SCHEMBL2311723 | 0.69 | ALDH1A1 (0.47) | CYP1A2CYP2D6CYP2C9CYP2C19PKM | |
| SCHEMBL5132516 | 0.69 | PKM (0.56) | CYP1A2CYP2D6CYP2C9CYP2C19PKM | |
| SCHEMBL3623804 | 0.68 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C9CYP2C19MAPK8 | |
| SCHEMBL30776972 | 0.68 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C9CYP2C19MAPK8 | |
| SCHEMBL21635610 | 0.66 | CYP1A2 (0.51) | CYP1A2CYP2D6CYP2C9CYP2C19MAPK8 | |
| SCHEMBL2315505 | 0.66 | TSHR (0.51) | CYP1A2CYP2D6CYP2C9CYP2C19 |
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-0907666-A1 | PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS | G.D. Searle & Co. (US) | 1999-04-14 | — | — | EP | disclosed |
| WO-1997049736-A2 | PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS | G.D. SEARLE AND CO. (US) | 1997-12-31 | — | — | WO | disclosed |