Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 2/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.31 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7359311 | 1.00 | ECE1 (0.44) | ECE1CYP2D6CYP2C19MMP8MMP1 | |
| SCHEMBL14456269 | 0.90 | ECE1 (0.39) | ECE1CYP2D6CYP2C19MMP8MMP1 | |
| SCHEMBL14199861 | 0.86 | ECE1 (0.47) | ECE1CYP2D6CYP2C19MAPTALDH1A1 | |
| SCHEMBL17826032 | 0.81 | MAPT (0.44) | CYP2D6CYP2C19MMP8MAPTALDH1A1 | |
| SCHEMBL19901822 | 0.81 | CYP2D6 (0.38) | ECE1CYP2D6CYP2C19MMP8MMP1 | |
| SCHEMBL3856802 | 0.78 | ECE1 (0.42) | ECE1PDCD1LG2CD274 | |
| SCHEMBL7034111 | 0.78 | ECE1 (0.42) | ECE1PDCD1LG2CD274 | |
| SCHEMBL9905434 | 0.76 | ECE1 (0.41) | ECE1PDCD1LG2CD274 | |
| SCHEMBL8420550 | 0.76 | ECE1 (0.35) | ECE1PDCD1LG2CD274 | |
| SCHEMBL8420547 | 0.76 | ECE1 (0.35) | ECE1PDCD1LG2CD274 |
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-1005448-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | Du Pont Pharmaceuticals Company (US) | 2000-06-07 | — | — | EP | disclosed |
| WO-1999009000-A2 | NOVEL INHIBITORS OF AGGRECANASE AND MATRIX METALLOPROTEINASES FOR THE TREATMENT OF ARTHRITIS | DU PONT PHARMACEUTICALS COMPANY (US) | 1999-02-25 | — | — | WO | disclosed |