Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | PRF1 | P14222 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 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 | |
|---|---|---|---|---|
| SCHEMBL10291882 | 0.85 | ESR1 (0.34) | ESR1ESR2PRF1 | |
| SCHEMBL26481735 | 0.84 | PRF1 (0.34) | PRF1 | |
| SCHEMBL10292365 | 0.83 | RARB (0.36) | ESR1ESR2PRF1 | |
| SCHEMBL12770290 | 0.80 | ESR1 (0.44) | ESR1ESR2PDE3BPDE3AAR | |
| SCHEMBL22872103 | 0.80 | ESR1 (0.44) | ESR1ESR2PDE3BPDE3AAR | |
| SCHEMBL22872125 | 0.75 | ESR1 (0.40) | ESR1ESR2PDE3BPDE3AAR | |
| SCHEMBL15096133 | 0.75 | APP (0.41) | ESR1ESR2PRF1HSD17B1HSD17B2 | |
| SCHEMBL24300960 | 0.74 | ESR1 (0.39) | ESR1ESR2PDE3BPDE3APTGS2 | |
| SCHEMBL4427979 | 0.74 | PDE3B (0.41) | PDE3BPDE3APTGS2RPS6KA3PDK2 | |
| SCHEMBL172021 | 0.74 | PDE3B (0.41) | PDE3BPDE3APTGS2RPS6KA3PDK2 |
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-2024126567-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2024-06-20 | — | — | WO | disclosed |