Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 8/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | TDO2 | P48775 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9160478 | 1.00 | TRPV3 (0.36) | TRPV3ALDH1A1OPRL1MAPTMAPK1 | |
| SCHEMBL9154346 | 0.95 | TRPV3 (0.34) | TRPV3ALDH1A1OPRL1 | |
| SCHEMBL9154329 | 0.95 | TRPV3 (0.34) | TRPV3ALDH1A1OPRL1 | |
| SCHEMBL9154336 | 0.95 | TRPV3 (0.34) | TRPV3ALDH1A1OPRL1 | |
| SCHEMBL9154322 | 0.95 | TRPV3 (0.34) | TRPV3ALDH1A1OPRL1 | |
| SCHEMBL9155885 | 0.87 | CYP2C9 (0.39) | ALDH1A1OPRL1MAPTMAPK1IDO1 | |
| SCHEMBL9155881 | 0.87 | CYP2C9 (0.39) | ALDH1A1OPRL1MAPTMAPK1IDO1 | |
| SCHEMBL9154321 | 0.84 | GAA (0.40) | OPRL1MAPTMAPK1 | |
| SCHEMBL9154330 | 0.84 | GAA (0.40) | OPRL1MAPTMAPK1 | |
| SCHEMBL8970349 | 0.83 | CYP2C9 (0.37) | ALDH1A1OPRL1MAPTMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445248-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |