Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6286485 | 0.80 | EPHX1 (0.40) | SIGMAR1 | |
| SCHEMBL19492608 | 0.80 | MTNR1A (0.42) | CYP2D6CYP2C19SIGMAR1ALDH1A1 | |
| SCHEMBL6290267 | 0.78 | EPHX1 (0.40) | CYP2D6CYP2C19SIGMAR1ALDH1A1 | |
| SCHEMBL6283592 | 0.77 | — | — | |
| SCHEMBL2407844 | 0.77 | ALDH1A1 (0.39) | BCAT2CYP2D6CYP2C19TDP1ALDH1A1 | |
| SCHEMBL6290107 | 0.77 | EPHX1 (0.35) | CYP2D6CYP2C19SIGMAR1 | |
| SCHEMBL23863 | 0.74 | — | — | |
| SCHEMBL8977572 | 0.74 | TSHR (0.45) | CYP2D6CYP2C19TDP1ALDH1A1 | |
| SCHEMBL3889578 | 0.73 | — | — | |
| SCHEMBL6943089 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6916854-B2 | Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-12 | — | — | US | disclosed |
| US-20040097642-A1 | Unsaturated compounds containing carbamate terminal groups or urea terminal groups | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-20 | — | — | US | disclosed |