Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.50 |
| ▸ | RXRB | P28702 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL26173346 | 0.97 | RXRA (0.48) | RXRARXRBCNR2ALDH1A1ACHE | |
| SCHEMBL20382350 | 0.95 | RXRA (0.45) | RXRARXRBCNR2ESR1HSD17B1 | |
| SCHEMBL18308799 | 0.90 | RXRA (0.42) | RXRARXRBCNR2ACHEESR1 | |
| SCHEMBL18621840 | 0.89 | RXRA (0.42) | RXRARXRBACHEESR1HSD17B1 | |
| SCHEMBL18308813 | 0.83 | RXRA (0.37) | RXRARXRBCNR2ALDH1A1TSHR | |
| SCHEMBL18308782 | 0.81 | RXRA (0.36) | RXRARXRBCNR2 | |
| SCHEMBL1687651 | 0.80 | ACHE (0.50) | ALDH1A1ACHETSHRTDP1 | |
| SCHEMBL12991138 | 0.80 | ACHE (0.50) | ALDH1A1ACHETSHRTDP1 | |
| SCHEMBL1046627 | 0.80 | RXRA (0.56) | RXRARXRBCNR2ALDH1A1ACHE | |
| SCHEMBL18806016 | 0.80 | RXRA (0.35) | RXRARXRBCNR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230183571-A1 | LIQUID-CRYSTAL MEDIUM COMPRISING POLYMERIZABLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2023-06-15 | — | — | US | disclosed |