Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 8/20 | 0.51 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | CTSD | P07339 | 4/20 | 0.44 |
| ▸ | MMP10 | P09238 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3686913 | 0.86 | MMP13 (0.58) | MMP13ROCK2ROCK1CTSD | |
| SCHEMBL8061043 | 0.85 | MMP13 (0.51) | MMP13MMP10MMP9MMP8XDH | |
| SCHEMBL14256298 | 0.84 | MMP13 (0.70) | MMP13ROCK2ROCK1MMP10MMP9 | |
| SCHEMBL3694242 | 0.81 | MMP13 (0.62) | MMP13ROCK2ROCK1CTSD | |
| SCHEMBL8071850 | 0.78 | MMP13 (0.52) | MMP13ROCK2ROCK1CTSDXDH | |
| SCHEMBL3801193 | 0.74 | MMP13 (0.64) | MMP13 | |
| SCHEMBL3801187 | 0.74 | MMP13 (0.64) | MMP13 | |
| SCHEMBL8055185 | 0.74 | MMP13 (0.54) | MMP13MMP10MMP9MMP8XDH | |
| SCHEMBL15646098 | 0.74 | XDH (0.56) | MMP13ROCK2ROCK1XDH | |
| SCHEMBL8069461 | 0.74 | MMP13 (0.58) | MMP13ROCK2ROCK1MMP10MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009016498-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | PFIZER INC. (US) | 2009-02-05 | — | — | WO | disclosed |