Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30799257 | 1.00 | CYP3A4 (0.46) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL29159497 | 1.00 | CYP3A4 (0.46) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL29159496 | 1.00 | CYP3A4 (0.46) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL26649200 | 0.87 | CYP19A1 (0.39) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL4743516 | 0.81 | CYP3A4 (0.53) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL29155970 | 0.79 | CYP3A4 (0.49) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL10203908 | 0.77 | CYP3A4 (0.50) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL30799408 | 0.76 | CYP3A4 (0.47) | CYP3A4LMNACYP2C9CHRM4CHRM5 | |
| SCHEMBL14113498 | 0.71 | — | — | |
| SCHEMBL14149503 | 0.71 | — | — |
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-117603169-A | Method for synthesizing key intermediate of pilocarpine | 杭州澳赛诺生物科技有限公司 | 2024-02-27 | — | — | CN | disclosed |