Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.36 |
| ▸ | GNAI3 | P08754 | 4/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 4/20 | 0.35 |
| ▸ | GBA2 | Q9HCG7 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23251452 | 0.98 | S1PR1 (0.43) | S1PR1S1PR3S1PR5GBA1S1PR4 | |
| SCHEMBL22871223 | 0.93 | S1PR1 (0.46) | S1PR1S1PR3S1PR5GBA1S1PR4 | |
| SCHEMBL21859862 | 0.93 | S1PR1 (0.46) | S1PR1S1PR3S1PR5GBA1S1PR4 | |
| SCHEMBL18963699 | 0.87 | GBA1 (0.36) | S1PR1S1PR3S1PR5GBA1 | |
| SCHEMBL25959090 | 0.84 | S1PR1 (0.41) | S1PR1S1PR3S1PR5GBA1S1PR4 | |
| SCHEMBL15473845 | 0.82 | GBA1 (0.37) | GBA1 | |
| SCHEMBL13085461 | 0.80 | KDM4E (0.31) | — | |
| SCHEMBL23251451 | 0.80 | KDM4E (0.31) | — | |
| SCHEMBL24437087 | 0.80 | KDM4E (0.31) | — | |
| SCHEMBL13297144 | 0.79 | S1PR1 (0.41) | S1PR1S1PR3S1PR5GBA1S1PR4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103073476-B | Synthetic method of N-aryl-5-trifluoromethyl-2-pyrrolidone and N-aryl-6-trifluoromethyl-2-pyridine alkyl ketone | UNIV NORTHWEST NORMAL | 2015-03-04 | — | — | CN | claimed |