Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | SIK1 | P57059 | 1/20 | 0.35 |
| ▸ | RIPK4 | P57078 | 1/20 | 0.35 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | DSTYK | Q6XUX3 | 1/20 | 0.35 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 7/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12856683 | 0.88 | FASN (0.45) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL20219207 | 0.83 | KDM1A (0.35) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL13614962 | 0.83 | CYP3A4 (0.37) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL2741531 | 0.83 | FASN (0.47) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL91987 | 0.83 | FASN (0.47) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL21387527 | 0.82 | CYP3A4 (0.53) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL14173388 | 0.82 | APP (0.47) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL13408581 | 0.82 | FASN (0.46) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL13083626 | 0.81 | CYP3A4 (0.55) | CYP3A4CYP2C9APPCYP2D6CYP2C19 | |
| SCHEMBL13083558 | 0.80 | FASN (0.40) | CYP3A4CYP2C9APPCYP2D6CYP2C19 |
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-2212308-B1 | BENZO[F]CHROME AND PYRANO[3,2-F]CHROME DERIVATIVES FOR USE IN LIQUID CRYSTAL MEDIA | MERCK PATENT GMBH (DE) | 2013-05-22 | — | — | EP | disclosed |