Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.39 |
| ▸ | LPAR2 | Q9HBW0 | 5/20 | 0.39 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 9/20 | 0.35 |
| ▸ | CA2 | P00918 | 9/20 | 0.35 |
| ▸ | CA9 | Q16790 | 9/20 | 0.35 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 2/20 | 0.34 |
| ▸ | CA6 | P23280 | 2/20 | 0.34 |
| ▸ | CA5A | P35218 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11665350 | 0.84 | CES1 (0.37) | LPAR3LPAR2LPAR1CES1CA1 | |
| SCHEMBL29842064 | 0.83 | — | — | |
| SCHEMBL22788087 | 0.79 | CES1 (0.39) | LPAR3LPAR2LPAR1CES1CA1 | |
| SCHEMBL2421173 | 0.76 | CA1 (0.38) | LPAR3LPAR2LPAR1CA1CA2 | |
| SCHEMBL12468266 | 0.76 | LPAR3 (0.41) | LPAR3LPAR2LPAR1CES1CA1 | |
| SCHEMBL6610038 | 0.76 | CA1 (0.38) | LPAR3LPAR2LPAR1CA1CA2 | |
| SCHEMBL1817037 | 0.74 | CA1 (0.40) | LPAR3LPAR2LPAR1CA1CA2 | |
| SCHEMBL4454457 | 0.74 | LPAR3 (0.45) | LPAR3LPAR2LPAR1CES1CA1 | |
| SCHEMBL3263695 | 0.74 | CA1 (0.37) | LPAR3LPAR2LPAR1CA1CA2 | |
| SCHEMBL28468879 | 0.74 | CA1 (0.40) | LPAR3LPAR2LPAR1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4170653-A | Antidepressant naphthyloxy piperidino and pyrrolidino propanol ethers | Ayerst McKenna and Harrison Limited (CA) | 1979-10-09 | — | — | US | disclosed |
| US-4060613-A | ANTIDEPRESSANT | AYERST MCKENNA AND HARRISON LTD. (CA) | 1977-11-29 | — | — | US | disclosed |