Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.60 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.57 |
| ▸ | PRKACA | P17612 | 2/20 | 0.57 |
| ▸ | PRKX | P51817 | 2/20 | 0.57 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.57 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | GSK3A | P49840 | 1/20 | 0.57 |
| ▸ | GSK3B | P49841 | 1/20 | 0.57 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | GRK5 | P34947 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.55 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8055231 | 0.82 | MMP13 (0.58) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL5252907 | 0.82 | ROCK2 (0.64) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL5209384 | 0.82 | MMP13 (0.72) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL8358822 | 0.81 | MMP13 (0.69) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL7010262 | 0.81 | KMT2A (0.59) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL7010267 | 0.81 | LMNA (0.61) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL8067349 | 0.80 | MMP13 (0.55) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL3694194 | 0.79 | MMP13 (0.51) | MMP13ROCK1ROCK2KMT2AALDH1A1 | |
| SCHEMBL8348366 | 0.78 | MMP13 (0.61) | MMP13ROCK1PRKACAPRKXPRKCQ | |
| SCHEMBL5096069 | 0.78 | ROCK2 (0.59) | MMP13ROCK1PRKACAPRKXPRKCQ |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2704712-A1 | ISOXAZOLINES AS THERAPEUTIC AGENTS | AbbVie Inc. (US) | 2014-03-12 | — | — | EP | disclosed |
| WO-2012151158-A1 | ISOXAZOLINES AS THERAPEUTIC AGENTS | ABBOTT LABORATORIES (US) | 2012-11-08 | — | — | WO | disclosed |
| EP-2185537-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | Pfizer Inc. (US) | 2010-05-19 | — | — | EP | disclosed |
| WO-2009016498-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS | PFIZER INC. (US) | 2009-02-05 | — | — | WO | disclosed |