Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.41 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL14942315 | 0.89 | APP (0.35) | TRPM8RAB9ACYP3A4CYP2C19CYP17A1 | |
| SCHEMBL442378 | 0.88 | ALDH1A1 (0.35) | TRPM8CYP3A4CYP2C19CYP17A1CYP2C9 | |
| SCHEMBL456036 | 0.88 | CYP2C9 (0.38) | MAPTNPC1RAB9ACYP3A4CYP2C19 | |
| SCHEMBL9854911 | 0.88 | ALOX5 (0.36) | CYP3A4CYP2C19CYP17A1CYP2C9PARP15 | |
| SCHEMBL4131407 | 0.83 | CYP17A1 (0.33) | CYP3A4CYP2C19CYP17A1CYP2C9 | |
| SCHEMBL4125025 | 0.83 | CHRNA3 (0.34) | — | |
| SCHEMBL4129963 | 0.82 | CHRNB2 (0.40) | — | |
| SCHEMBL4124970 | 0.81 | CYP17A1 (0.32) | CYP3A4CYP2C19CYP17A1CYP2C9 | |
| SCHEMBL18890846 | 0.80 | MRGPRX4 (0.35) | CYP3A4CYP2C19CYP17A1CYP2C9L3MBTL1 | |
| SCHEMBL12066132 | 0.77 | APP (0.33) | CYP3A4CYP2C19CYP17A1CYP2C9PARP15 |
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-0409418-A1 | Heterocyclic tertiary alcohols | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-23 | — | — | EP | disclosed |