Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.67 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.55 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.52 |
| ▸ | PRKACA | P17612 | 2/20 | 0.52 |
| ▸ | PRKX | P51817 | 2/20 | 0.52 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9416645 | 0.84 | MMP13 (0.94) | MMP13LMNAHPGDMEN1USP2 | |
| SCHEMBL4664685 | 0.83 | MAPK14 (0.60) | MMP13CHRM3LMNAHPGDROCK2 | |
| SCHEMBL15012854 | 0.82 | NMT1 (0.65) | MEN1KMT2AHRH1 | |
| SCHEMBL31061610 | 0.81 | MMP13 (1.00) | MMP13LMNAHPGDMEN1USP2 | |
| SCHEMBL5332068 | 0.81 | MMP13 (1.00) | MMP13LMNAHPGDMEN1USP2 | |
| SCHEMBL15028387 | 0.80 | NMT1 (0.80) | USP2 | |
| SCHEMBL13746152 | 0.79 | ALDH1A1 (0.74) | MMP13LMNAEPHX2ALDH1A1KMT2A | |
| SCHEMBL30475500 | 0.78 | HPGD (0.61) | MMP13CHRM3LMNAHPGDALDH1A1 | |
| SCHEMBL12813045 | 0.78 | MMP13 (0.82) | MMP13LMNAHPGDMEN1USP2 | |
| SCHEMBL2807802 | 0.78 | EPHX2 (0.55) | EPHX2GSK3BHRH1 |
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-2013083991-A1 | NOVEL COMPOUNDS AND THEIR USE IN THERAPY | IMPERIAL INNOVATIONS LIMITED (GB) | 2013-06-13 | — | — | WO | disclosed |