Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 10/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9509049 | 1.00 | SPHK1 (0.34) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL7910615 | 0.99 | CYP2C9 (0.34) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9510166 | 0.96 | CYP2C9 (0.34) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9508780 | 0.95 | SPHK1 (0.33) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9512396 | 0.95 | SPHK1 (0.33) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9511345 | 0.95 | RAB9A (0.34) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9509024 | 0.95 | RAB9A (0.34) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9512361 | 0.94 | SPHK1 (0.33) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9511489 | 0.94 | SPHK1 (0.33) | SPHK1CYP2C9MAPTGAAMEN1 | |
| SCHEMBL9510157 | 0.94 | RAB9A (0.34) | SPHK1CYP2C9MAPTMEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | claimed |
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |