Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 5/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD5 | P21918 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3840832 | 0.94 | PTGES (0.46) | PTGESFFAR1DRD2DRD1DRD4 | |
| SCHEMBL3840726 | 0.92 | KCNH2 (0.45) | PTGESFFAR1DRD2DRD1DRD4 | |
| SCHEMBL3863069 | 0.92 | KCNH2 (0.45) | PTGESFFAR1DRD2DRD1DRD4 | |
| SCHEMBL13959503 | 0.81 | PTGES (0.46) | PTGESFFAR1DRD2DRD3FFAR4 | |
| SCHEMBL234655 | 0.81 | PTGES (0.46) | PTGESFFAR1FFAR4HAO1 | |
| SCHEMBL3836802 | 0.78 | PTGES (0.50) | PTGESFFAR1DRD2DRD3KCNH2 | |
| SCHEMBL233649 | 0.76 | PTGES (0.44) | PTGESFFAR1FFAR4HAO1KCNH2 | |
| SCHEMBL13908245 | 0.76 | PTGES (0.47) | PTGESFFAR1FFAR4HCRTR1HCRTR2 | |
| SCHEMBL3860260 | 0.75 | PTGES (0.46) | PTGES | |
| SCHEMBL233926 | 0.75 | PTGES (0.43) | PTGESFFAR1FFAR4HAO1GRM5 |
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-2076122-A2 | ALKYNYL PHENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2009-07-08 | — | — | EP | disclosed |
| WO-2009005794-A2 | ALKYNYL PHENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS | ACUCELA, INC. (US) | 2009-01-08 | — | — | WO | disclosed |