Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9067048 | 0.92 | F2 (0.45) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL9067050 | 0.85 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL28008276 | 0.83 | CYP3A4 (0.52) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL28152981 | 0.80 | CYP3A4 (0.53) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL9705831 | 0.80 | CYP2D6 (0.50) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL28041491 | 0.79 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL27466587 | 0.77 | CYP3A4 (0.54) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL9067415 | 0.76 | F2 (0.40) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL7708867 | 0.76 | CYP3A4 (0.53) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 | |
| SCHEMBL29756083 | 0.74 | CYP3A4 (0.52) | CYP3A4CYP2D6CYP2C19CYP4F2CYP4A11 |
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-0726903-A1 | MATRIX METALLOPROTEASE INHIBITORS | SYNTEX INC (US) | 1996-08-21 | — | — | EP | disclosed |
| WO-1995012603-A1 | MATRIX METALLOPROTEASE INHIBITORS________________________________ | SYNTEX (U.S.A.) INC. (US) | 1995-05-11 | — | — | WO | disclosed |