Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.32 |
| ▸ | ESR1 | P03372 | 5/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21581474 | 1.00 | ALOX5 (0.33) | ALOX5ESR2ESR1CYP3A4CYP2D6 | |
| SCHEMBL21581470 | 0.97 | ESR2 (0.35) | ALOX5ESR2ESR1CYP3A4CYP2D6 | |
| SCHEMBL21581469 | 0.95 | ESR1 (0.31) | ESR2ESR1CYP3A4CYP2C9 | |
| SCHEMBL20003593 | 0.93 | OPRL1 (0.35) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8767554 | 0.90 | OPRL1 (0.37) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8767218 | 0.90 | OPRL1 (0.37) | ALOX5ESR2ESR1CYP3A4CYP2D6 | |
| SCHEMBL8767561 | 0.90 | OPRL1 (0.37) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8767547 | 0.90 | OPRL1 (0.37) | ESR2ESR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8768502 | 0.87 | SIGMAR1 (0.37) | ALOX5ESR2OPRL1 | |
| SCHEMBL8767048 | 0.87 | OPRL1 (0.35) | ALOX5ESR2ESR1CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |