Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 4/20 | 0.37 |
| ▸ | KDR | P35968 | 5/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | SLC5A1 | P13866 | 3/20 | 0.34 |
| ▸ | BRAF | P15056 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9104786 | 0.89 | RAF1 (0.49) | RAF1KDRBRAFMAPT | |
| SCHEMBL9102036 | 0.89 | MAPT (0.41) | KDRPLK1MAPTTP53 | |
| SCHEMBL4470556 | 0.89 | RAF1 (0.49) | RAF1KDREPHX2BRAF | |
| SCHEMBL9103055 | 0.86 | LMNA (0.44) | RAF1KDRMAPTTP53 | |
| SCHEMBL9102033 | 0.85 | LCLAT1 (0.42) | KDRMAPT | |
| SCHEMBL9100020 | 0.81 | RAF1 (0.55) | RAF1KDRBRAFMAPT | |
| SCHEMBL9098846 | 0.81 | KDR (0.49) | RAF1KDRBRAFMAPT | |
| SCHEMBL9100015 | 0.81 | KDR (0.38) | RAF1KDRBRAFMAPT | |
| SCHEMBL9099762 | 0.80 | KDR (0.42) | RAF1KDRBRAFMAPTTP53 | |
| SCHEMBL9103231 | 0.79 | KDR (0.42) | RAF1KDR |
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-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | claimed |
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |