Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER4 | P35408 | 2/20 | 0.40 |
| ▸ | TSPO | P30536 | 1/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5204784 | 1.00 | PTGER4 (0.40) | PTGER4TSPOPTGER2SCN9ACTSK | |
| SCHEMBL5204339 | 0.92 | SCN9A (0.39) | PTGER4TSPOPTGER2SCN9ACTSK | |
| SCHEMBL5206532 | 0.92 | SCN9A (0.39) | PTGER4TSPOPTGER2SCN9ACTSK | |
| SCHEMBL5206331 | 0.86 | TSPO (0.37) | PTGER4TSPOSCN9A | |
| SCHEMBL5204846 | 0.85 | HDAC1 (0.42) | TSPOROCK2ROCK1PPARGCYP3A4 | |
| SCHEMBL5205558 | 0.84 | HDAC1 (0.42) | TSPOROCK2ROCK1PPARGCYP3A4 | |
| SCHEMBL5208483 | 0.79 | SCN9A (0.36) | TSPOSCN9AMEN1KMT2ACYP2C9 | |
| SCHEMBL5205929 | 0.78 | PPARG (0.40) | TSPOSCN9AROCK2ROCK1PPARG | |
| SCHEMBL5205699 | 0.77 | AHCY (0.37) | TSPOROCK2ROCK1PPARGCYP3A4 | |
| SCHEMBL5206135 | 0.76 | PPARG (0.39) | TSPOPPARGCYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7160887-B1 | Aromatic amine derivatives, their production and use | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-01-09 | — | — | US | disclosed |
| EP-1123918-B1 | AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | TAKEDA PHARMACEUTICAL (JP) | 2005-03-09 | — | — | EP | disclosed |
| EP-1123918-A1 | AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME | Takeda Chemical Industries, Ltd. (JP) | 2001-08-16 | — | — | EP | disclosed |