Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 12/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL23370327 | 1.00 | ESR1 (0.43) | ESR1ESR2MAPTPTGDR2CCR1 | |
| SCHEMBL23370322 | 0.84 | ESR1 (0.40) | ESR1ESR2PTGDR2CNR1CNR2 | |
| SCHEMBL24854462 | 0.81 | ESR1 (0.36) | ESR1ESR2CNR1CNR2 | |
| SCHEMBL23370329 | 0.81 | ADORA2A (0.39) | ESR1PTGDR2CNR2ALDH1A1HTT | |
| SCHEMBL29617945 | 0.78 | ESR1 (0.34) | ESR1MAPTPTGDR2HTTL3MBTL1 | |
| SCHEMBL24854569 | 0.74 | PTGDR2 (0.32) | ESR1MAPTPTGDR2L3MBTL1 | |
| SCHEMBL24854251 | 0.74 | PTGDR2 (0.33) | ESR1PTGDR2L3MBTL1 | |
| SCHEMBL23370330 | 0.74 | ESR1 (0.33) | ESR1L3MBTL1 | |
| SCHEMBL24854151 | 0.72 | KCNMA1 (0.38) | MAPT | |
| SCHEMBL23370339 | 0.72 | HTR2A (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022092084-A1 | FUSED HETEROCYCLE DERIVATIVE AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT | クミアイ化学工業株式会社 | 2022-05-05 | — | — | WO | disclosed |