Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8602484 | 0.89 | SQOR (0.38) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8602621 | 0.86 | SQOR (0.31) | — | |
| SCHEMBL8598099 | 0.86 | CYP2D6 (0.38) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8597104 | 0.86 | CYP2D6 (0.31) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8603884 | 0.84 | CYP2D6 (0.34) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8599817 | 0.83 | PORCN (0.34) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8601450 | 0.82 | CYP11B1 (0.41) | CYP19A1 | |
| SCHEMBL8601152 | 0.81 | CYP2D6 (0.30) | CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL8598478 | 0.81 | AAK1 (0.32) | — | |
| SCHEMBL8601925 | 0.79 | CYP2D6 (0.38) | CYP2D6CYP19A1CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |