Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | IL1RN | P18510 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27912595 | 0.90 | LCK (0.62) | LCKFYNSLC7A5CA1CA2 | |
| SCHEMBL9161519 | 0.89 | CA1 (0.52) | SLC7A5CA1CA2CYP2C19TDP1 | |
| SCHEMBL8782111 | 0.87 | CA1 (0.53) | SLC7A5CA1CA2CYP2C19TDP1 | |
| SCHEMBL1602982 | 0.85 | LCK (0.48) | LCKFYNSLC7A5CA1CA2 | |
| SCHEMBL28345285 | 0.85 | SLC7A5 (0.57) | SLC7A5CA1CA2TDP1ALDH1A1 | |
| SCHEMBL3292533 | 0.84 | SLC7A5 (0.58) | SLC7A5CA1CA2TDP1ALDH1A1 | |
| SCHEMBL31148945 | 0.84 | LCK (0.50) | LCKFYNSLC7A5CA1CA2 | |
| SCHEMBL3846745 | 0.84 | LCK (0.50) | LCKFYNSLC7A5CA1CA2 | |
| SCHEMBL31148946 | 0.84 | LCK (0.50) | LCKFYNSLC7A5CA1CA2 | |
| SCHEMBL29540241 | 0.84 | SLC7A5 (0.58) | SLC7A5CA1CA2TDP1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112552499-B | Block polyester polyol, preparation method thereof and waterborne polyurethane | 万华化学集团股份有限公司 | 2022-07-12 | — | — | CN | claimed |