Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 6/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24769849 | 0.79 | P2RX7 (0.54) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29875113 | 0.79 | P2RX7 (0.54) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29874953 | 0.79 | P2RX7 (0.54) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL24810886 | 0.79 | P2RX7 (0.54) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL31707067 | 0.79 | P2RX7 (0.54) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL24769085 | 0.78 | P2RX7 (0.51) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30157991 | 0.78 | P2RX7 (0.56) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL31706320 | 0.78 | P2RX7 (0.56) | P2RX7HTTCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL8759521 | 0.77 | PER2 (0.44) | HTTCYP2D6CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL30158003 | 0.75 | P2RX7 (0.56) | P2RX7HTTCYP2D6CYP2C9CYP2C19 |
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-2022200208-A1 | SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES | BAYER AKTIENGESELLSCHAFT (DE) | 2022-09-29 | — | — | WO | disclosed |