Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 3/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | PREP | P48147 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL29131551 | 0.81 | AKT1 (0.40) | CES1AKT1ALDH1A1MAPK1TDP1 | |
| SCHEMBL4412147 | 0.79 | CES1 (0.48) | CES1AKT1ALDH1A1MAPK1TDP1 | |
| SCHEMBL11043913 | 0.78 | CES1 (0.42) | CES1ALDH1A1CES2PREPNPC1 | |
| SCHEMBL11043916 | 0.78 | CES1 (0.42) | CES1ALDH1A1CES2PREPNPC1 | |
| SCHEMBL27392108 | 0.76 | AKT1 (0.36) | AKT1ALDH1A1TDP1TSHR | |
| SCHEMBL3731523 | 0.76 | CES1 (0.48) | CES1AKT1ALDH1A1MAPK1TDP1 | |
| SCHEMBL20919883 | 0.76 | CES1 (0.48) | CES1ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL28269583 | 0.76 | CES1 (0.48) | CES1ALDH1A1MAPK1TDP1TSHR | |
| SCHEMBL15137388 | 0.74 | CES1 (0.46) | CES1AKT1ALDH1A1MAPK1TDP1 | |
| SCHEMBL15137342 | 0.74 | CES1 (0.46) | CES1AKT1ALDH1A1MAPK1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116875181-A | High-hardness hydrophobic finish varnish and preparation method thereof | 广东美涂士建材股份有限公司 | 2023-10-13 | — | — | CN | claimed |
| CN-117186129-A | Method for preparing cis-allyl borate and allyl alcohol from cis/trans conjugated diene mixture | 成都理工大学 | 2023-12-08 | — | — | CN | disclosed |
| CN-116875181-A | High-hardness hydrophobic finish varnish and preparation method thereof | 广东美涂士建材股份有限公司 | 2023-10-13 | — | — | CN | disclosed |