Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 11/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3380597 | 0.88 | ACHE (0.50) | ACHECYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL12277147 | 0.83 | ACHE (0.55) | ACHECYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL22036373 | 0.81 | ACHE (0.62) | ACHECYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL1197941 | 0.79 | CYP2C9 (0.44) | ACHECYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL20138448 | 0.78 | ACHE (0.51) | ACHE | |
| SCHEMBL1198561 | 0.76 | ACHE (0.41) | ACHECYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL31352301 | 0.76 | FDFT1 (0.42) | ACHECYP2C9CYP2C19ALDH1A1LMNA | |
| SCHEMBL5106095 | 0.76 | CYP1A2 (0.47) | CYP2C9CYP2C19ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL29014753 | 0.76 | ACHE (0.49) | ACHE | |
| SCHEMBL10615235 | 0.75 | L3MBTL1 (0.46) | ACHECYP2C9CYP2C19ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-116056697-A | 2-oxo-oxazolidine-5-carboxamides as NAV1.8 inhibitors | 默沙东有限责任公司 | 2023-05-02 | — | — | CN | disclosed |