Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 3/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.38 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GCGR | P47871 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8767205 | 1.00 | CYP3A4 (0.42) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL10014266 | 0.86 | GRM2 (0.45) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL8767158 | 0.84 | L3MBTL1 (0.44) | GABBR2GABBR1L3MBTL1S1PR1GRIN2B | |
| SCHEMBL8767160 | 0.84 | L3MBTL1 (0.44) | GABBR2GABBR1L3MBTL1S1PR1GRIN2B | |
| SCHEMBL16579008 | 0.83 | GRM2 (0.43) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL6453913 | 0.82 | GRM2 (0.41) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL6453917 | 0.82 | GRM2 (0.41) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL8767731 | 0.82 | MEN1 (0.44) | L3MBTL1S1PR1GRIN2BHRH3MEN1 | |
| SCHEMBL9358101 | 0.82 | GRM2 (0.42) | CYP3A4CYP2C9APPGRM2GABBR2 | |
| SCHEMBL9358091 | 0.82 | GRM2 (0.42) | CYP3A4CYP2C9APPGRM2GABBR2 |
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 |