Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8767142 | 1.00 | APP (0.34) | APPCYP3A4CYP2C9HSP90AA1GAA | |
| SCHEMBL8768289 | 0.86 | — | — | |
| SCHEMBL8767053 | 0.85 | PTGDR (0.34) | APPCYP3A4CYP2C9HSP90AA1GAA | |
| SCHEMBL8767051 | 0.85 | PTGDR (0.34) | APPCYP3A4CYP2C9HSP90AA1GAA | |
| SCHEMBL13454593 | 0.85 | NPC1 (0.31) | APPNPC1RAB9A | |
| SCHEMBL6458293 | 0.81 | ESR2 (0.31) | — | |
| SCHEMBL6458296 | 0.81 | ESR2 (0.31) | — | |
| SCHEMBL8767041 | 0.81 | CYP3A4 (0.36) | APPCYP3A4CYP2C9HSP90AA1GAA | |
| SCHEMBL8767043 | 0.81 | CYP3A4 (0.36) | APPCYP3A4CYP2C9HSP90AA1GAA | |
| SCHEMBL8393093 | 0.80 | JAK2 (0.30) | — |
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 |