Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.51 |
| ▸ | CES1 | P23141 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | STS | P08842 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL29199431 | 1.00 | CES2 (0.51) | CES2CES1PARP1STSLMNA | |
| SCHEMBL29199435 | 0.82 | HPGD (0.51) | CES2CES1PARP1LMNANPC1 | |
| SCHEMBL1172431 | 0.77 | CES2 (0.54) | CES2CES1PARP1STSLMNA | |
| SCHEMBL4823687 | 0.77 | CES2 (0.77) | CES2CES1PARP1STSCNR2 | |
| SCHEMBL31414638 | 0.77 | CES2 (0.77) | CES2CES1PARP1STSCNR2 | |
| Hydrochloric Acid SCHEMBL27733557 | 0.75 | CES2 (0.74) | CES2CES1PARP1STSCNR2 | |
| SCHEMBL30301363 | 0.73 | FAAH (0.59) | CES2CES1PARP1STSLMNA | |
| SCHEMBL4820908 | 0.72 | CES2 (0.69) | CES2CES1PARP1STSCNR2 | |
| SCHEMBL755443 | 0.72 | MEN1 (0.69) | CES2CES1PARP1STSLMNA | |
| SCHEMBL30414806 | 0.72 | MEN1 (0.69) | CES2CES1PARP1STSLMNA |
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 |