Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 20/20 | 0.59 |
| ▸ | ESR1 | P03372 | 12/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL3807813 | 1.00 | ESR2 (0.59) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL4816643 | 0.91 | ESR2 (0.63) | ESR2ESR1 | |
| SCHEMBL9066299 | 0.88 | ESR2 (0.59) | ESR2ESR1 | |
| SCHEMBL9849920 | 0.87 | ESR2 (0.61) | ESR2ESR1CYP2C9 | |
| SCHEMBL3809870 | 0.86 | ESR2 (0.51) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL3192802 | 0.85 | ESR2 (0.54) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL30165897 | 0.83 | ESR1 (0.69) | ESR2ESR1 | |
| SCHEMBL4200651 | 0.83 | ESR1 (0.69) | ESR2ESR1 | |
| SCHEMBL29393324 | 0.83 | ESR1 (0.69) | ESR2ESR1 | |
| SCHEMBL2951103 | 0.82 | ESR2 (0.61) | ESR2ESR1CYP3A4CYP2C9CYP2D6 |
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 |