Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.35 |
| ▸ | BCL9 | O00512 | 1/20 | 0.33 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29195952 | 1.00 | ALDH1A1 (0.48) | ALDH1A1LMNAMAPTMAPK1TSHR | |
| SCHEMBL20588856 | 0.84 | LMNA (0.63) | ALDH1A1LMNAMAPTMAPK1TSHR | |
| SCHEMBL9490792 | 0.81 | — | — | |
| SCHEMBL11317853 | 0.79 | — | — | |
| SCHEMBL7989056 | 0.79 | ALDH1A1 (0.50) | ALDH1A1LMNAMAPTMAPK1TSHR | |
| SCHEMBL7929901 | 0.79 | — | — | |
| SCHEMBL2719944 | 0.76 | ALDH1A1 (0.52) | ALDH1A1LMNAMAPTMAPK1TSHR | |
| SCHEMBL7285498 | 0.76 | — | — | |
| SCHEMBL5930621 | 0.76 | ALDH1A1 (0.52) | ALDH1A1LMNAMAPTMAPK1TSHR | |
| SCHEMBL6207422 | 0.76 | ESR1 (0.32) | ESR1HIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112739683-B | Preparation method of brivaracetam and intermediate thereof | 上海宣泰医药科技股份有限公司 | 2024-04-16 | — | — | CN | disclosed |
| CN-109748876-A | Etomidate derivative and preparation method thereof | 北京蓝丹医药科技有限公司 | 2019-05-14 | — | — | CN | disclosed |