Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | DGKA | P23743 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | BCL9 | O00512 | 1/20 | 0.31 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL446877 | 0.87 | TSHR (0.41) | ALDH1A1TSHRLMNAMAPT | |
| SCHEMBL28917632 | 0.86 | CES1 (0.43) | ALDH1A1CES1CES2TSHRLMNA | |
| SCHEMBL29031639 | 0.85 | DGKA (0.50) | ALDH1A1CES1CES2TSHRLMNA | |
| SCHEMBL5884669 | 0.83 | DGKA (0.53) | ALDH1A1CES1CES2TSHRLMNA | |
| SCHEMBL29031643 | 0.82 | ALDH1A1 (0.52) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL28236422 | 0.81 | SQLE (0.31) | TSHR | |
| SCHEMBL8526100 | 0.80 | — | — | |
| SCHEMBL11482842 | 0.79 | ALDH1A1 (0.48) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL848574 | 0.79 | PHF8 (0.45) | ALDH1A1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL28047872 | 0.79 | TSHR (0.59) | ALDH1A1TSHRLMNAMAPT |
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-109704895-A | A kind of bulk emulsifying explosive and preparation method thereof | 廖书辉 | 2019-05-03 | — | — | CN | claimed |
| CN-111164148-B | Thermosetting resin composition | 共荣社化学株式会社 | 2022-10-18 | — | — | CN | disclosed |