Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 6/20 | 0.50 |
| ▸ | MMP14 | P50281 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | GCK | P35557 | 1/20 | 0.43 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP13 | P45452 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2764219 | 1.00 | ADAMTS5 (0.50) | ADAMTS5MMP14MAPK1CYP2C19CA12 | |
| SCHEMBL2764220 | 1.00 | ADAMTS5 (0.50) | ADAMTS5MMP14MAPK1CYP2C19CA12 | |
| SCHEMBL2763847 | 0.89 | LMNA (0.48) | MAPK1SLC6A9HTTGAANOTUM | |
| SCHEMBL2763845 | 0.89 | LMNA (0.48) | MAPK1SLC6A9HTTGAANOTUM | |
| SCHEMBL2766104 | 0.89 | ADAMTS5 (0.53) | ADAMTS5MMP14MAPK1CYP2C19TP53 | |
| SCHEMBL2766099 | 0.89 | ADAMTS5 (0.53) | ADAMTS5MMP14MAPK1CYP2C19TP53 | |
| SCHEMBL2763946 | 0.86 | ADAMTS5 (0.66) | ADAMTS5MMP14MAPK1CYP2C19THRB | |
| SCHEMBL2763947 | 0.86 | ADAMTS5 (0.66) | ADAMTS5MMP14MAPK1CYP2C19THRB | |
| SCHEMBL2765968 | 0.85 | HTT (0.50) | HTTGAA | |
| SCHEMBL2765969 | 0.85 | HTT (0.50) | HTTGAA |
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-1694410-A2 | CYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF | Japan Tobacco, Inc. (JP) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005058884-A2 | CYCLOPROPANE COMPOUNDS AND PHARMACEUTICAL USE THEREOF | JAPAN TOBACCO INC. (JP) | 2005-06-30 | — | — | WO | disclosed |