Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15189657 | 1.00 | AMY1A (0.39) | AMY1AESR1ESR2CETPTYR | |
| SCHEMBL29636480 | 1.00 | AMY1A (0.39) | AMY1AESR1ESR2CETPTYR | |
| SCHEMBL6847207 | 1.00 | AMY1A (0.39) | AMY1AESR1ESR2CETPTYR | |
| SCHEMBL30375444 | 0.90 | TYR (0.42) | AMY1AESR1ESR2TYRSHBG | |
| SCHEMBL29636469 | 0.90 | TYR (0.42) | AMY1AESR1ESR2TYRSHBG | |
| SCHEMBL3196356 | 0.90 | TYR (0.42) | AMY1AESR1ESR2TYRSHBG | |
| SCHEMBL22500140 | 0.88 | ESR1 (0.36) | AMY1AESR1ESR2CETPTYR | |
| SCHEMBL4064013 | 0.86 | AMY1A (0.41) | AMY1AESR1ESR2CETPTYR | |
| SCHEMBL278560 | 0.82 | AMY1A (0.62) | AMY1AESR1ESR2MEN1MAPT | |
| SCHEMBL30002986 | 0.82 | AMY1A (0.62) | AMY1AESR1ESR2MEN1MAPT |
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-113646052-B | Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument | 百乐墨水株式会社 | 2024-05-17 | — | — | CN | disclosed |
| CN-113785023-B | Water-based ink composition for reversible thermochromic writing instrument, refill for refill and water-based ballpoint pen incorporating same | 株式会社百乐 | 2023-05-12 | — | — | CN | disclosed |