Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL102961 | 0.91 | ALDH1A1 (0.44) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL28033954 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL28268839 | 0.86 | LMNA (0.48) | TSHRLMNADNM1 | |
| SCHEMBL81340 | 0.85 | ALDH1A1 (0.48) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL102584 | 0.83 | LMNA (0.48) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL11254695 | 0.82 | ALDH1A1 (0.48) | ALDH1A1TDP1CYP3A4TSHRLMNA | |
| SCHEMBL198808 | 0.81 | LMNA (0.52) | ALDH1A1TSHRLMNADNM1 | |
| SCHEMBL199832 | 0.81 | LMNA (0.52) | ALDH1A1TSHRLMNADNM1 | |
| SCHEMBL101339 | 0.81 | LMNA (0.52) | ALDH1A1TSHRLMNADNM1 | |
| SCHEMBL102172 | 0.81 | LMNA (0.52) | ALDH1A1TSHRLMNADNM1 |
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-112047964-A | Preparation method and application of Grignard reagent | 宋喂 | 2020-12-08 | — | — | CN | claimed |
| CN-112047964-A | Preparation method and application of Grignard reagent | 宋喂 | 2020-12-08 | — | — | CN | disclosed |