Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ESRRG | P62508 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ESRRB | O95718 | 1/20 | 0.31 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30375400 | 0.86 | ESR1 (0.39) | ESR1ESR2CYP3A4ALOX15MAPK1 | |
| SCHEMBL30375421 | 0.85 | SHBG (0.35) | ESR1ALOX15MAPK1HTTKLF10 | |
| SCHEMBL30084871 | 0.82 | ALOX15 (0.36) | ESR1ESR2CYP3A4ALOX15MAPK1 | |
| SCHEMBL30375290 | 0.82 | AMY1A (0.50) | ESR1ESR2CYP3A4ALOX15MAPK1 | |
| SCHEMBL30374864 | 0.82 | ESR1 (0.41) | ESR1ESR2ALOX15MAPK1HTT | |
| SCHEMBL4063699 | 0.82 | ALOX15 (0.46) | ESR1ESR2CYP3A4ALOX15MAPK1 | |
| SCHEMBL30375252 | 0.81 | KLF10 (0.32) | ESR1ALOX15MAPK1HTTKLF10 | |
| SCHEMBL29852196 | 0.80 | ESR1 (0.41) | ESR1ESR2CYP3A4ALOX15MAPK1 | |
| SCHEMBL30374981 | 0.78 | ESR1 (0.41) | ESR1ESR2ALOX15MAPK1HTT | |
| SCHEMBL4061811 | 0.78 | ALOX15 (0.41) | ESR1ESR2CYP3A4ALOX15MAPK1 |
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-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 |