Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 12/20 | 0.39 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL8774120 | 1.00 | CYP2C9 (0.43) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774688 | 0.93 | SPHK1 (0.42) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774693 | 0.93 | SPHK1 (0.42) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774733 | 0.92 | SPHK1 (0.44) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774728 | 0.92 | SPHK1 (0.44) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774183 | 0.91 | SPHK1 (0.46) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774177 | 0.91 | SPHK1 (0.46) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8774426 | 0.84 | PDGFRB (0.39) | CYP2C9 | |
| SCHEMBL8774416 | 0.84 | PDGFRB (0.39) | CYP2C9 | |
| SCHEMBL9154858 | 0.84 | CYP2C9 (0.46) | CYP2C9ALDH1A1LMNAMAPTMEN1 |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |