Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 12/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19873573 | 1.00 | ROCK2 (0.34) | ROCK2ROCK1LMNALPAR1LPAR3 | |
| SCHEMBL19873643 | 0.93 | LPAR1 (0.41) | ROCK2ROCK1LPAR1LPAR3ENPP2 | |
| SCHEMBL19873642 | 0.93 | LPAR1 (0.41) | ROCK2ROCK1LPAR1LPAR3ENPP2 | |
| SCHEMBL19873557 | 0.91 | LPAR1 (0.38) | ROCK2ROCK1LPAR1LPAR3PI4KB | |
| SCHEMBL19873596 | 0.91 | LPAR1 (0.34) | ROCK2ROCK1LPAR1LPAR3PI4KB | |
| SCHEMBL19873556 | 0.91 | LPAR1 (0.38) | ROCK2ROCK1LPAR1LPAR3PI4KB | |
| SCHEMBL19873594 | 0.91 | LPAR1 (0.34) | ROCK2ROCK1LPAR1LPAR3PI4KB | |
| SCHEMBL19873655 | 0.90 | TACR2 (0.31) | LMNALPAR1LPAR3ENPP2ALDH1A1 | |
| SCHEMBL19873545 | 0.90 | LPAR1 (0.38) | LPAR1LPAR3ENPP2 | |
| SCHEMBL19873543 | 0.90 | LPAR1 (0.38) | LPAR1LPAR3ENPP2 |
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-3360869-B1 | HALOGEN-SUBSTITUTED HETEROCYCLIC COMPOUND USEFUL FOR THE TREATMENT OF DISEASES CAUSED BY LPA. | UBE INDUSTRIES (JP) | 2020-07-29 | — | — | EP | claimed |
| EP-2940013-B1 | HALOGEN-SUBSTITUTED HETEROCYCLIC COMPOUND | UBE INDUSTRIES (JP) | 2018-02-21 | — | — | EP | claimed |