Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | STAT3 | P40763 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21156703 | 1.00 | CYP19A1 (0.49) | CYP19A1ATMKDM4EDAOHSP90AA1 | |
| SCHEMBL30866420 | 0.88 | PTPN1 (0.54) | CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL21122490 | 0.88 | PTPN1 (0.54) | CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL22554383 | 0.87 | CA2 (0.54) | ATMKDM4EPOLBCYP3A4CA2 | |
| SCHEMBL30866427 | 0.87 | CA2 (0.54) | ATMKDM4EPOLBCYP3A4CA2 | |
| SCHEMBL28417902 | 0.83 | AKR1B1 (0.47) | KDM4ECA2 | |
| SCHEMBL21157986 | 0.81 | RAB9A (0.48) | KDM4EDAOPOLBNR1H3ALDH1A1 | |
| SCHEMBL21157261 | 0.79 | TAAR1 (0.49) | DAONR1H2NR1H3ALDH1A1AOC3 | |
| SCHEMBL31157848 | 0.76 | CYP19A1 (0.77) | CYP19A1ATMKDM4EDAOHSP90AA1 | |
| SCHEMBL16641094 | 0.76 | CYP19A1 (0.77) | CYP19A1ATMKDM4EDAOHSP90AA1 |
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-111587239-B | Method for producing lactam compound and lactam compound produced by the method | 基础科学研究院 | 2024-04-02 | — | — | CN | disclosed |