Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 11/20 | 0.51 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | PRKCG | P05129 | 1/20 | 0.45 |
| ▸ | PRKACA | P17612 | 1/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | PRKX | P51817 | 1/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.45 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.45 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.45 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6238788 | 0.79 | SMN1; SMN2 (0.56) | MMP13NR1H4EPHX2ROCK2RPS6KA5 | |
| SCHEMBL6230534 | 0.78 | NR1H4 (0.55) | MMP13NR1H4EPHX2ROCK2RPS6KA5 | |
| SCHEMBL6231446 | 0.75 | GAA (0.56) | MMP13NR1H4EPHX2MAPK1 | |
| SCHEMBL8358422 | 0.75 | MMP13 (0.68) | MMP13ROCK2RPS6KA5MAP4K4PRKCG | |
| SCHEMBL6234382 | 0.74 | NR1H4 (0.56) | MMP13NR1H4EPHX2PTGER4 | |
| SCHEMBL6264658 | 0.74 | NR1H4 (0.56) | MMP13NR1H4EPHX2 | |
| SCHEMBL6234969 | 0.74 | NR1H4 (0.56) | MMP13NR1H4EPHX2PTGER4 | |
| SCHEMBL6231783 | 0.74 | MMP13 (0.53) | MMP13NR1H4EPHX2ROCK2ROCK1 | |
| SCHEMBL6271126 | 0.73 | MMP13 (0.54) | MMP13NR1H4EPHX2MAPK1 | |
| SCHEMBL17132817 | 0.72 | MMP13 (0.71) | MMP13NR1H4EPHX2PTGER4EGFR |
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-2003032999-A1 | ALKYNE MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2003-04-24 | — | — | WO | disclosed |