Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 3/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.30 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5982091 | 0.83 | HTR2A (0.32) | — | |
| SCHEMBL5668048 | 0.82 | CYP11B1 (0.32) | — | |
| SCHEMBL815618 | 0.81 | BCHE (0.35) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29213166 | 0.81 | BCHE (0.35) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10644406 | 0.79 | TSHR (0.36) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| Fluoride Ion SCHEMBL1131501 | 0.79 | BCHE (0.34) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| SCHEMBL18242642 | 0.79 | CYP3A4 (0.36) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11590486 | 0.79 | BCHE (0.34) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL813274 | 0.79 | BCHE (0.34) | BCHEACHECYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29960196 | 0.78 | CYP3A4 (0.33) | BCHEACHECYP3A4CYP2D6CYP2C9 |
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-2006065809-A2 | HETEROATOM BRIDGED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-06-22 | — | — | WO | disclosed |