Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 4/20 | 0.38 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30375009 | 0.90 | ESR1 (0.48) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL30320268 | 0.90 | ESR1 (0.43) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL28680993 | 0.90 | ESR1 (0.43) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL30375052 | 0.89 | ESRRG (0.38) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL27002596 | 0.83 | ESR1 (0.41) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL30374729 | 0.83 | ESR1 (0.41) | SHBGESRRGRORCESR1KLF10 | |
| SCHEMBL30320269 | 0.81 | ESR1 (0.56) | ESRRGRORCESR1KLF10ALOX15 | |
| SCHEMBL30375183 | 0.80 | RORC (0.37) | ESRRGRORCESR1KLF10PDE4A | |
| SCHEMBL30374761 | 0.79 | CA2 (0.40) | RORCESR1KLF10ALOX15ALOX12 | |
| SCHEMBL30374574 | 0.79 | RORC (0.38) | RORCESR1KLF10PDE4AALOX15 |
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 |