Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.53 |
| ▸ | CASP3 | P42574 | 3/20 | 0.53 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.53 |
| ▸ | SENP6 | Q9GZR1 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PPIA | P62937 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27267807 | 0.84 | POLB (0.53) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL19808952 | 0.83 | TDP1 (0.59) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL28041139 | 0.82 | POLB (0.57) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL2835796 | 0.82 | POLB (0.57) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL20201222 | 0.82 | POLB (0.57) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL23996876 | 0.81 | POLB (0.56) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL1495328 | 0.80 | BRD4 (0.60) | L3MBTL1CASP3SENP8SENP7SENP6 | |
| SCHEMBL20457001 | 0.79 | POLB (0.62) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL3579374 | 0.79 | POLB (1.00) | POLBL3MBTL1CASP3SENP8SENP7 | |
| SCHEMBL28002780 | 0.79 | POLB (0.69) | POLBL3MBTL1CASP3SENP8SENP7 |
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-112794844-B | Ester compound, preparation method and application thereof, and ester soft medicine | 中国科学院上海药物研究所 | 2023-03-21 | — | — | CN | disclosed |
| CN-112794844-A | Ester compound, preparation method and application thereof, and ester soft medicine | 中国科学院上海药物研究所 | 2021-05-14 | — | — | CN | disclosed |