Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | LTB4R | Q15722 | 4/20 | 0.46 |
| ▸ | LTB4R2 | Q9NPC1 | 4/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15504953 | 0.86 | CYP1A2 (0.43) | CYP2C19CYP1A2LTB4RLTB4R2CYP4F2 | |
| SCHEMBL129672 | 0.86 | CYP2C19 (0.53) | CYP2C19CYP1A2LTB4RLTB4R2CYP4F2 | |
| SCHEMBL186895 | 0.83 | CYP2C19 (0.48) | CYP2C19CYP1A2KMT2AMAPTTRPA1 | |
| SCHEMBL129671 | 0.83 | CYP2C19 (0.50) | CYP2C19CYP1A2LTB4RLTB4R2CYP4F2 | |
| SCHEMBL15504951 | 0.82 | CYP4F2 (0.45) | CYP2C19CYP1A2CYP4F2CYP4A11KMT2A | |
| SCHEMBL2060545 | 0.82 | CYP2C19 (0.47) | CYP2C19CYP1A2CYP4F2CYP4A11KMT2A | |
| SCHEMBL31477275 | 0.81 | CYP2C19 (0.49) | CYP2C19CYP1A2LTB4RLTB4R2CYP4F2 | |
| SCHEMBL2060663 | 0.80 | CNR2 (0.45) | CYP2C19CYP1A2CYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL2640714 | 0.80 | CYP1A2 (0.44) | CYP2C19CYP1A2CYP4F2CYP4A11KMT2A | |
| SCHEMBL479996 | 0.78 | CES2 (0.46) | LTB4RLTB4R2MAP4K4KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2284157-A1 | Quinolines useful in treating cardiovascular disease | Wyeth (US) | 2011-02-16 | — | — | EP | disclosed |