Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 5/20 | 0.33 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18486758 | 0.98 | CYP3A4 (0.36) | P2RY14ESR2CYP3A4CYP2C9APP | |
| SCHEMBL8767914 | 0.91 | P2RY14 (0.33) | P2RY14ESR2GRM4 | |
| SCHEMBL8767510 | 0.86 | GRM5 (0.41) | P2RY14ESR2CYP3A4CYP2C9APP | |
| SCHEMBL2741543 | 0.85 | ESR2 (0.50) | P2RY14ESR2CYP3A4CYP2C9GRM4 | |
| SCHEMBL17851229 | 0.82 | ESR2 (0.37) | P2RY14ESR2CYP3A4CYP2C9MAPT | |
| SCHEMBL23510979 | 0.81 | CYP3A4 (0.34) | P2RY14CYP3A4CYP2C9APPHDAC1 | |
| SCHEMBL6462913 | 0.79 | CYP2C9 (0.47) | P2RY14ESR2CYP3A4CYP2C9MAPT | |
| SCHEMBL9398338 | 0.79 | CYP2C9 (0.47) | P2RY14ESR2CYP3A4CYP2C9MAPT | |
| SCHEMBL25919448 | 0.79 | CYP3A4 (0.34) | P2RY14CYP3A4CYP2C9APPHDAC1 | |
| SCHEMBL26373090 | 0.79 | CYP3A4 (0.32) | P2RY14ESR2CYP3A4CYP2C9APP |
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 |