Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.63 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.58 |
| ▸ | ABHD6 | Q9BV23 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.42 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | GHSR | Q92847 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30199574 | 0.88 | NR1H2 (0.63) | NR1H2ESR2ABHD6MAPTHDAC1 | |
| SCHEMBL1011003 | 0.88 | NR1H2 (0.72) | NR1H2ESR2ABHD6MAPTHDAC1 | |
| SCHEMBL29587073 | 0.88 | NR1H2 (0.72) | NR1H2ESR2ABHD6MAPTHDAC1 | |
| Hydrochloric Acid SCHEMBL38653092 | 0.87 | NR1H2 (0.70) | NR1H2ESR2ABHD6MAPTHDAC1 | |
| SCHEMBL25430802 | 0.86 | NR1H2 (0.61) | NR1H2ESR2ABHD6MAPTMAPK1 | |
| SCHEMBL30519086 | 0.86 | NR1H2 (0.61) | NR1H2ESR2ABHD6MAPTMAPK1 | |
| SCHEMBL29098095 | 0.86 | NR1H2 (0.57) | NR1H2ESR2ABHD6MAPTGAA | |
| SCHEMBL30199521 | 0.86 | NR1H2 (0.57) | NR1H2ESR2ABHD6MAPTGAA | |
| SCHEMBL30390692 | 0.84 | NR1H2 (0.70) | NR1H2ESR2ABHD6MAPTMAPK1 | |
| SCHEMBL6438594 | 0.84 | NR1H2 (0.70) | NR1H2ESR2ABHD6MAPTMAPK1 |
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-115594669-A | Fused ring derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |